data_2m9f_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 2m9f _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -147.99 179.94 7.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 124.651 1.18 . . . . 0.0 110.571 178.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.77 130.58 50.57 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.322 1.449 . . . . 0.0 108.382 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -120.57 127.95 52.62 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.518 1.927 . . . . 0.0 110.705 -169.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -78.87 93.05 4.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 123.897 0.879 . . . . 0.0 110.688 172.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.265 1.4 p-80 -73.1 22.66 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mt -110.99 -19.21 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 125.346 1.458 . . . . 0.0 109.949 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.4 p -134.01 -21.61 1.87 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.057 1.343 . . . . 0.0 114.515 -174.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 80.07 8.73 1.46 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 128.765 2.826 . . . . 0.0 114.053 -169.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.3 151.77 42.89 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.953 1.251 . . . . 0.0 111.835 173.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.5 p -142.97 130.57 21.28 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.294 1.038 . . . . 0.0 112.199 -176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 124.437 1.095 . . . . 0.0 110.967 -176.236 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 122.941 1.353 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -154.4 179.75 8.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 112.514 -2.13 . . . . 0.0 107.641 -176.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -119.48 141.26 49.33 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.135 0.974 . . . . 0.0 109.197 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -127.3 128.66 46.32 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.061 1.745 . . . . 0.0 109.705 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -88.36 105.47 17.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -75.98 5.61 6.34 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -101.54 -38.54 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 124.138 0.975 . . . . 0.0 110.329 170.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -106.46 -8.96 16.87 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -176.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.99 10.74 5.56 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.928 1.691 . . . . 0.0 113.792 -170.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.2 155.74 34.05 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 120.823 -1.173 . . . . 0.0 111.884 171.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.5 p -143.3 139.16 30.0 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.323 1.049 . . . . 0.0 111.023 175.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 124.186 0.994 . . . . 0.0 111.5 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.5 t . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.245 0.545 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -148.95 179.56 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.22 1.008 . . . . 0.0 110.146 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -121.08 141.15 51.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.194 1.398 . . . . 0.0 109.845 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.22 116.96 22.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.787 1.635 . . . . 0.0 110.891 -169.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -67.36 96.23 0.48 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.329 1.052 . . . . 0.0 110.976 172.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -71.33 7.13 1.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.7 mt -96.1 -20.02 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.569 1.148 . . . . 0.0 110.444 172.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.6 p -136.09 -19.31 1.51 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -172.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 80.1 5.46 1.82 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.913 2.885 . . . . 0.0 113.634 -169.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.1 129.9 41.4 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.914 1.233 . . . . 0.0 111.962 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.7 p -117.59 122.41 43.55 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.093 1.357 . . . . 0.0 111.601 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 . . . . . 0 N--CA 1.471 0.614 0 C-N-CA 124.23 1.012 . . . . 0.0 112.667 -179.703 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.471 0.602 0 CA-C-O 121.43 0.634 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -148.99 -174.52 4.66 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.403 1.881 . . . . 0.0 109.344 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -125.57 139.6 53.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.276 1.03 . . . . 0.0 109.621 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -135.6 128.59 31.45 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.935 1.294 . . . . 0.0 111.27 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -75.26 94.4 2.99 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.693 1.997 . . . . 0.0 110.851 170.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.256 1.9 p-80 -76.7 29.97 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -116.43 -22.37 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 125.662 1.585 . . . . 0.0 109.374 169.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -137.8 -17.08 1.27 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 80.08 -1.97 2.02 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 129.322 3.049 . . . . 0.0 113.976 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.66 129.57 39.68 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.549 1.068 . . . . 0.0 109.078 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.1 139.51 22.44 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.843 -0.535 . . . . 0.0 112.053 -169.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 125.435 1.494 . . . . 0.0 110.41 -174.259 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 121.757 0.789 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -152.96 -179.28 7.53 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 126.154 1.782 . . . . 0.0 109.263 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -120.11 140.18 51.46 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.836 1.254 . . . . 0.0 109.564 170.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -123.28 117.05 24.39 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.024 0.93 . . . . 0.0 110.201 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -71.23 91.15 0.94 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.907 0.883 . . . . 0.0 109.947 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -72.3 8.18 1.45 Allowed 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.3 mt -93.7 -21.51 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.69 1.196 . . . . 0.0 110.451 170.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.8 p -138.2 -18.0 1.17 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -170.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 80.05 2.4 2.03 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.751 3.221 . . . . 0.0 113.9 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 129.9 41.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.078 1.308 . . . . 0.0 112.114 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 98.7 p -112.4 127.52 56.05 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.126 -0.984 . . . . 0.0 112.215 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 . . . . . 0 N--CA 1.467 0.402 0 C-N-CA 125.929 1.691 . . . . 0.0 110.152 -178.025 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.471 0.614 0 CA-C-O 121.758 0.79 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -152.54 179.89 8.19 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.538 1.935 . . . . 0.0 109.454 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -116.34 137.94 51.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 122.332 1.063 . . . . 0.0 111.237 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -124.34 119.26 28.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.959 1.704 . . . . 0.0 109.779 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.0 95.56 0.96 Allowed 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.231 1.012 . . . . 0.0 110.778 175.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -71.24 9.7 0.71 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -178.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.74 -20.8 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 125.141 1.377 . . . . 0.0 110.593 173.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -138.67 -5.61 1.54 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.087 1.355 . . . . 0.0 114.536 -171.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.322 0.2 OUTLIER 58.02 16.76 3.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.95 2.1 . . . . 0.0 114.706 -169.473 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.6 155.3 39.46 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 119.586 1.085 . . . . 0.0 110.704 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.6 p -147.95 128.43 14.04 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.219 -0.926 . . . . 0.0 112.505 -173.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 . . . . . 0 N--CA 1.467 0.408 0 C-N-CA 123.492 0.717 . . . . 0.0 112.638 174.958 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -151.95 179.44 8.46 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.636 1.174 . . . . 0.0 110.475 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -116.17 139.35 50.42 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.182 1.393 . . . . 0.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -123.23 114.84 20.79 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.681 1.992 . . . . 0.0 109.585 -169.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -68.84 101.01 1.26 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.827 0.851 . . . . 0.0 110.972 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -71.22 0.48 7.79 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.1 mt -94.04 -20.2 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.358 1.063 . . . . 0.0 110.565 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -135.19 -20.44 1.66 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 79.98 3.7 2.0 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 128.923 2.889 . . . . 0.0 113.514 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.24 136.76 57.91 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.796 1.18 . . . . 0.0 111.469 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.3 p -125.96 122.8 37.0 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.193 0.997 . . . . 0.0 111.636 -174.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 124.0 0.92 . . . . 0.0 112.166 -178.474 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.0 t . . . . . 0 N--CA 1.472 0.668 0 CA-C-O 121.653 0.74 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -153.65 -172.85 4.36 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.203 1.801 . . . . 0.0 110.16 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.53 137.89 54.38 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.968 1.307 . . . . 0.0 110.195 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -125.95 126.2 43.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.3 1.44 . . . . 0.0 110.224 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -80.97 94.89 6.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.664 0.785 . . . . 0.0 110.244 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -71.87 6.15 2.2 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.9 mm -95.58 -21.7 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.448 1.099 . . . . 0.0 111.304 170.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.9 p -136.75 -11.66 1.78 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -169.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 69.69 11.11 7.82 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.909 1.683 . . . . 0.0 113.546 -169.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 157.73 31.36 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 120.092 1.315 . . . . 0.0 111.899 169.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -147.93 134.81 20.12 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.274 -0.891 . . . . 0.0 112.106 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 . . . . . 0 N--CA 1.468 0.467 0 C-N-CA 125.211 1.404 . . . . 0.0 110.642 177.771 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.471 0.583 0 CA-C-O 121.847 0.832 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -141.96 179.67 6.74 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.423 1.889 . . . . 0.0 109.795 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -118.14 134.76 54.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.943 0.878 . . . . 0.0 110.136 176.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -121.94 130.61 53.47 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.127 1.771 . . . . 0.0 110.705 -169.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -82.72 101.44 10.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.436 0.694 . . . . 0.0 111.013 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -68.53 -4.91 16.82 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.2 mt -92.6 -19.91 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.443 1.097 . . . . 0.0 110.694 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.7 p -136.7 -11.06 1.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -170.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 66.55 12.53 8.8 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.177 1.391 . . . . 0.0 113.136 -170.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.88 33.27 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.467 -1.395 . . . . 0.0 111.454 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.4 p -151.14 129.78 12.28 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.162 -0.961 . . . . 0.0 111.918 -175.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 . . . . . 0 N--CA 1.468 0.45 0 C-N-CA 124.664 1.185 . . . . 0.0 112.302 -177.611 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -150.65 179.59 8.06 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.211 1.804 . . . . 0.0 109.772 -177.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -111.16 135.07 52.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.687 1.195 . . . . 0.0 112.148 169.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -130.95 136.42 48.54 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.554 1.142 . . . . 0.0 111.938 -174.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -88.84 98.86 11.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.662 0.785 . . . . 0.0 110.618 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -76.04 25.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.4 mt -122.45 -40.01 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.127 1.371 . . . . 0.0 109.803 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -101.23 -22.11 14.73 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 79.58 8.01 1.75 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.05 2.94 . . . . 0.0 114.013 -170.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.16 153.28 30.67 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.256 0.935 . . . . 0.0 112.09 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -142.74 150.19 39.75 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.273 1.029 . . . . 0.0 112.232 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.356 0 C-N-CA 124.601 1.161 . . . . 0.0 110.931 174.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 t . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.52 0.676 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.04 179.63 7.6 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.988 1.315 . . . . 0.0 109.386 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -118.05 143.03 46.77 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.746 1.218 . . . . 0.0 110.853 170.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -129.89 122.11 27.99 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.801 1.64 . . . . 0.0 109.241 -170.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -72.28 91.39 1.31 Allowed 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 110.379 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.264 1.5 p-80 -73.88 26.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 177.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.9 mt -114.13 -20.12 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 126.011 1.724 . . . . 0.0 109.633 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.1 p -134.73 -21.28 1.72 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.227 1.411 . . . . 0.0 114.623 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 80.08 8.54 1.48 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.538 2.735 . . . . 0.0 114.018 -169.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.74 152.88 43.28 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.115 1.325 . . . . 0.0 111.461 172.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.9 p -147.06 138.23 23.95 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.213 -0.929 . . . . 0.0 112.64 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 123.562 0.745 . . . . 0.0 111.296 175.69 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 122.066 0.936 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -154.41 179.97 8.5 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.991 1.717 . . . . 0.0 109.256 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -117.85 140.46 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.542 1.137 . . . . 0.0 109.892 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -125.89 120.37 30.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.043 1.337 . . . . 0.0 110.599 -169.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -73.28 97.33 2.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.806 0.842 . . . . 0.0 110.71 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -71.43 3.28 3.93 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.9 mp -96.89 -23.64 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 110.758 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -130.52 -20.68 2.91 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 78.28 6.72 2.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.227 2.611 . . . . 0.0 113.53 -169.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.95 156.5 27.65 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.651 1.114 . . . . 0.0 111.383 172.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -144.14 150.03 37.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.382 -0.824 . . . . 0.0 112.734 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 . . . . . 0 CA--C 1.539 0.525 0 C-N-CA 125.193 1.397 . . . . 0.0 109.666 -176.723 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 121.481 0.658 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -149.69 -177.35 5.83 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.238 1.415 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.11 130.67 53.45 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.738 1.215 . . . . 0.0 108.98 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -124.91 140.03 53.3 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.245 1.418 . . . . 0.0 111.336 -169.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.54 104.41 16.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.358 0.663 . . . . 0.0 111.539 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -2.26 14.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.7 mm -91.55 -23.96 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.903 0.881 . . . . 0.0 111.447 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.1 p -133.6 -11.17 2.75 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -169.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 66.38 13.27 9.15 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.914 1.286 . . . . 0.0 113.101 -169.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.39 156.65 31.58 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.71 -1.244 . . . . 0.0 111.291 169.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.0 p -150.84 139.92 21.09 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.489 -0.757 . . . . 0.0 112.082 -178.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 125.111 1.364 . . . . 0.0 110.642 174.517 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 121.372 0.606 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -149.1 179.86 7.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.171 1.388 . . . . 0.0 110.742 178.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -114.88 133.19 56.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.548 1.539 . . . . 0.0 110.703 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -123.02 116.21 23.15 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.042 1.737 . . . . 0.0 109.031 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -74.39 97.32 3.03 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.511 0.724 . . . . 0.0 110.086 174.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -69.58 3.35 2.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.3 mt -95.43 -20.1 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 119.25 0.932 . . . . 0.0 110.978 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -134.11 -20.04 1.94 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -171.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 79.04 5.92 2.22 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 129.161 2.984 . . . . 0.0 113.154 -169.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.32 129.86 41.59 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.86 1.209 . . . . 0.0 111.253 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.5 p -120.41 123.3 42.71 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.144 0.977 . . . . 0.0 111.769 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 . . . . . 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 110.235 179.054 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.8 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 121.631 0.729 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -143.85 179.61 7.06 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.101 1.36 . . . . 0.0 109.822 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -122.76 143.52 49.77 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.096 1.359 . . . . 0.0 109.234 172.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -124.28 119.52 29.54 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.724 1.61 . . . . 0.0 110.633 -169.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -64.52 101.55 0.46 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.366 0.667 . . . . 0.0 109.992 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -75.41 3.64 8.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -97.46 -32.74 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.473 1.509 . . . . 0.0 110.214 174.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 32.0 p -119.09 -18.12 8.8 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 80.01 1.38 2.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 129.245 3.018 . . . . 0.0 114.38 -170.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.77 129.67 40.61 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.975 1.261 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.6 p -112.68 124.43 52.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.998 1.319 . . . . 0.0 111.541 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.868 0.842 . . . . 0.0 111.95 -179.047 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 121.898 0.856 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -151.12 179.9 7.88 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.381 1.472 . . . . 0.0 109.904 -177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -119.69 143.46 47.74 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.85 0.86 . . . . 0.0 109.594 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -131.52 140.06 49.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.631 1.572 . . . . 0.0 109.529 -173.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -98.38 94.96 7.03 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.681 0.792 . . . . 0.0 110.083 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.283 1.6 p-80 -74.82 20.18 0.13 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -178.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.4 mt -112.19 -17.66 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 C-N-CA 125.516 1.527 . . . . 0.0 110.183 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.8 p -135.18 -11.5 2.2 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -175.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.3 11.67 8.51 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.067 1.747 . . . . 0.0 113.659 -169.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.62 155.84 31.99 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.129 1.332 . . . . 0.0 111.869 170.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.8 p -150.55 140.48 21.93 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.05 0.94 . . . . 0.0 111.944 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 123.837 0.855 . . . . 0.0 112.799 176.952 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -149.55 179.5 7.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.713 0.768 . . . . 0.0 111.023 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -126.05 110.94 14.12 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 126.131 1.772 . . . . 0.0 110.891 -173.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -109.99 126.04 53.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 126.092 1.757 . . . . 0.0 111.816 -169.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -77.3 103.35 7.18 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.923 0.889 . . . . 0.0 109.148 169.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -75.93 15.22 0.56 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.2 mt -112.11 -39.99 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.003 1.321 . . . . 0.0 110.329 169.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.7 p -105.31 -20.0 13.63 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -177.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 79.46 2.79 2.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.821 2.848 . . . . 0.0 114.323 -171.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 129.96 44.3 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.605 1.093 . . . . 0.0 111.923 176.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -123.75 119.27 29.26 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.055 1.342 . . . . 0.0 111.438 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 N--CA 1.465 0.317 0 C-N-CA 124.068 0.947 . . . . 0.0 111.004 -176.142 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.469 0.507 0 CA-C-O 121.822 0.82 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -155.02 179.56 9.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.386 1.874 . . . . 0.0 108.808 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -113.87 137.8 51.18 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.421 1.488 . . . . 0.0 109.911 169.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -126.44 127.34 45.26 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.773 1.229 . . . . 0.0 110.189 -171.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -82.99 99.72 10.0 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 122.743 0.417 . . . . 0.0 110.202 170.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.94 6.13 5.57 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 17.4 mt -93.46 -40.07 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 123.679 0.792 . . . . 0.0 109.909 169.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.9 p -105.65 -20.68 13.39 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 79.99 6.75 1.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.321 3.048 . . . . 0.0 113.83 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.27 155.15 39.58 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.524 1.057 . . . . 0.0 112.731 177.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -140.98 133.47 28.47 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.722 1.209 . . . . 0.0 112.167 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 126.232 1.813 . . . . 0.0 110.17 -175.308 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.471 0.604 0 CA-C-O 121.491 0.662 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -150.15 179.32 8.18 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.081 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -116.76 145.59 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 169.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -127.8 112.98 15.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.559 1.944 . . . . 0.0 109.995 -169.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -67.5 97.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.198 0.999 . . . . 0.0 110.672 172.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -72.31 4.35 3.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.79 -19.39 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.367 1.067 . . . . 0.0 110.354 173.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -136.44 -20.26 1.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -172.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 80.08 6.29 1.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.187 2.995 . . . . 0.0 113.491 -169.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.72 129.91 41.44 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.883 1.219 . . . . 0.0 111.55 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -117.56 127.35 53.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.731 1.212 . . . . 0.0 111.45 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 121.585 0.707 . . . . 0.0 111.971 178.624 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.5 t . . . . . 0 N--CA 1.469 0.519 0 CA-C-O 121.672 0.749 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -152.26 179.76 8.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.353 1.461 . . . . 0.0 110.361 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -112.77 136.49 52.33 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 125.879 1.672 . . . . 0.0 110.426 171.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -123.44 124.52 43.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.591 1.556 . . . . 0.0 109.865 -169.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -75.96 97.95 4.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.918 0.487 . . . . 0.0 111.058 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -66.7 -4.86 9.91 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -178.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.4 mt -91.98 -20.46 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.476 1.11 . . . . 0.0 110.588 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.2 p -136.23 -21.8 1.37 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -171.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 79.59 7.73 1.78 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.488 2.715 . . . . 0.0 113.52 -169.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.03 159.48 17.07 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 119.646 1.112 . . . . 0.0 111.361 171.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.1 p -149.84 150.0 31.31 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.939 -1.101 . . . . 0.0 112.672 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 125.853 1.661 . . . . 0.0 109.785 -172.614 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.463 ' H3 ' ' CD ' ' A' ' 29' ' ' GLU . 36.2 mtmm . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 117.651 -1.166 . . . . 0.0 109.881 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 33.3 mt 73.68 119.65 0.03 OUTLIER Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 129.254 3.022 . . . . 0.0 116.542 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -72.03 174.92 10.55 Favored 'Trans proline' 0 CA--C 1.552 1.395 0 C-N-CA 123.118 2.545 . . . . 0.0 111.253 169.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.63 130.13 25.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.785 2.99 . . . . 0.0 114.212 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.21 -7.16 81.71 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.645 1.117 . . . . 0.0 115.854 173.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.13 131.85 34.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.742 1.271 . . . . 0.0 111.316 176.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -148.17 157.05 43.28 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.827 0.851 . . . . 0.0 110.94 -176.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -67.6 140.94 56.92 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.753 2.021 . . . . 0.0 114.155 -169.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -143.55 -179.83 6.67 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.656 2.382 . . . . 0.0 110.641 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.5 140.28 18.1 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.282 1.033 . . . . 0.0 111.238 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -81.87 130.78 35.18 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.882 2.073 . . . . 0.0 109.3 171.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.1 -26.88 66.57 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -72.4 3.83 4.39 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.583 1.553 . . . . 0.0 113.691 169.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.83 61.82 0.99 Allowed Glycine 0 C--N 1.341 0.858 0 C-N-CA 125.521 1.534 . . . . 0.0 114.859 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.1 m -153.16 133.17 13.31 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.668 1.734 . . . . 0.0 111.294 170.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.6 t -94.71 141.29 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.259 1.024 . . . . 0.0 109.646 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -147.99 179.94 7.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 124.651 1.18 . . . . 0.0 110.571 178.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.77 130.58 50.57 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.322 1.449 . . . . 0.0 108.382 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -120.57 127.95 52.62 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.518 1.927 . . . . 0.0 110.705 -169.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -78.87 93.05 4.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 123.897 0.879 . . . . 0.0 110.688 172.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.265 1.4 p-80 -73.1 22.66 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mt -110.99 -19.21 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 125.346 1.458 . . . . 0.0 109.949 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.4 p -134.01 -21.61 1.87 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.057 1.343 . . . . 0.0 114.515 -174.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 80.07 8.73 1.46 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 128.765 2.826 . . . . 0.0 114.053 -169.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.3 151.77 42.89 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.953 1.251 . . . . 0.0 111.835 173.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.5 p -142.97 130.57 21.28 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.294 1.038 . . . . 0.0 112.199 -176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -148.65 154.28 39.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.437 1.095 . . . . 0.0 110.967 -176.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -85.23 4.95 32.31 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.463 ' CD ' ' H3 ' ' A' ' 1' ' ' LYS . 3.3 tm-20 -64.67 109.7 2.1 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.619 1.568 . . . . 0.0 110.219 -177.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -98.43 134.85 21.48 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -169.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -83.39 -155.02 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.214 1 C-N-CA 125.401 4.067 . . . . 0.0 110.202 169.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.5 p -61.22 -23.38 65.58 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 120.387 -1.446 . . . . 0.0 114.172 170.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.028 0 C-N-CA 127.036 2.255 . . . . 0.0 114.034 -176.088 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.1 tptp . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 118.371 -0.823 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.19 158.92 82.81 Favored Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 118.742 -0.647 . . . . 0.0 109.863 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.67 170.83 11.81 Favored 'Trans proline' 0 CA--C 1.55 1.29 0 C-N-CA 123.461 2.774 . . . . 0.0 113.832 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -43.52 108.92 0.12 Allowed 'Trans proline' 0 C--N 1.354 0.834 1 C-N-CA 125.315 4.01 . . . . 0.0 115.703 -178.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.23 0.64 89.92 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.002 -1.444 . . . . 0.0 115.379 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -86.34 144.49 27.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.872 1.836 . . . . 0.0 112.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.62 153.9 46.24 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.023 2.129 . . . . 0.0 110.176 -175.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt -100.03 128.98 46.04 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.18 0.9 . . . . 0.0 111.602 -175.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.75 178.02 7.08 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 121.154 -0.966 . . . . 0.0 110.97 -169.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 60.2 ttm -154.32 121.06 5.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.678 1.991 . . . . 0.0 106.884 -173.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -67.71 161.74 25.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.766 1.226 . . . . 0.0 111.468 174.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.1 -11.6 14.98 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -93.34 0.39 56.9 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.538 1.535 . . . . 0.0 113.246 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.14 11.68 58.36 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.25 1.405 . . . . 0.0 115.281 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.1 m -95.01 118.83 32.49 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.723 1.761 . . . . 0.0 108.822 -169.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -94.39 155.6 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 122.941 1.353 . . . . 0.0 111.582 -176.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -154.4 179.75 8.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 112.514 -2.13 . . . . 0.0 107.641 -176.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -119.48 141.26 49.33 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.135 0.974 . . . . 0.0 109.197 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -127.3 128.66 46.32 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.061 1.745 . . . . 0.0 109.705 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -88.36 105.47 17.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -75.98 5.61 6.34 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -101.54 -38.54 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 124.138 0.975 . . . . 0.0 110.329 170.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -106.46 -8.96 16.87 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -176.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.99 10.74 5.56 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.928 1.691 . . . . 0.0 113.792 -170.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.2 155.74 34.05 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 120.823 -1.173 . . . . 0.0 111.884 171.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.5 p -143.3 139.16 30.0 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.323 1.049 . . . . 0.0 111.023 175.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -143.05 146.4 33.79 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.186 0.994 . . . . 0.0 111.5 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -84.4 -22.26 30.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.213 1.005 . . . . 0.0 111.711 169.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -62.41 109.61 1.41 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.362 0.528 . . . . 0.0 110.353 171.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.88 111.67 12.31 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.537 1.135 . . . . 0.0 113.467 -175.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -86.67 84.11 1.06 Allowed 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.739 2.293 . . . . 0.0 110.864 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 p 76.79 -8.4 1.68 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 129.646 3.178 . . . . 0.0 115.657 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.308 0 CA-C-O 116.814 -2.103 . . . . 0.0 115.219 177.551 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.454 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 27.4 tp -146.74 119.61 4.95 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 119.596 1.089 . . . . 0.0 110.628 172.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -80.31 166.41 20.34 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 122.861 2.374 . . . . 0.0 113.114 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.8 134.21 47.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.0 3.133 . . . . 0.0 113.889 172.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.42 -2.3 85.46 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-O 118.606 -1.108 . . . . 0.0 115.574 175.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -90.1 131.18 36.1 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.073 1.437 . . . . 0.0 111.013 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.47 147.09 48.77 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.017 0.927 . . . . 0.0 112.676 -171.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 pttm -66.92 123.7 20.91 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.71 2.004 . . . . 0.0 115.065 -169.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -130.33 177.73 7.12 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.495 1.918 . . . . 0.0 110.86 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.4 ttm -154.48 127.74 8.43 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.301 1.04 . . . . 0.0 110.632 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.411 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 71.9 m-85 -71.42 131.42 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.712 1.605 . . . . 0.0 109.503 169.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.99 -28.01 67.33 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -174.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -73.2 5.64 3.38 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.012 1.725 . . . . 0.0 113.689 170.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.54 63.82 1.07 Allowed Glycine 0 C--N 1.341 0.812 0 C-N-CA 125.608 1.575 . . . . 0.0 114.776 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 55.4 m -152.88 131.05 11.93 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.557 1.678 . . . . 0.0 111.199 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.5 t -94.69 142.4 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.846 0.858 . . . . 0.0 109.594 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -148.95 179.56 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.22 1.008 . . . . 0.0 110.146 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -121.08 141.15 51.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.194 1.398 . . . . 0.0 109.845 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.22 116.96 22.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.787 1.635 . . . . 0.0 110.891 -169.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -67.36 96.23 0.48 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.329 1.052 . . . . 0.0 110.976 172.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -71.33 7.13 1.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.7 mt -96.1 -20.02 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.569 1.148 . . . . 0.0 110.444 172.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.6 p -136.09 -19.31 1.51 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -172.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 80.1 5.46 1.82 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.913 2.885 . . . . 0.0 113.634 -169.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.1 129.9 41.4 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.914 1.233 . . . . 0.0 111.962 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.7 p -117.59 122.41 43.55 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.093 1.357 . . . . 0.0 111.601 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -139.54 153.93 47.55 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.23 1.012 . . . . 0.0 112.667 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -83.1 5.07 23.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.251 1.42 . . . . 0.0 114.222 -177.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.7 109.84 4.01 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.655 -0.653 . . . . 0.0 111.128 170.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.434 ' CZ ' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -97.08 154.39 38.18 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 126.389 1.876 . . . . 0.0 109.424 175.01 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -49.88 -35.07 38.98 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 124.206 3.271 . . . . 0.0 115.156 173.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.7 m -67.57 94.48 0.42 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 128.855 2.862 . . . . 0.0 111.733 173.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.175 0 CA-C-O 118.619 -1.101 . . . . 0.0 114.489 171.679 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.411 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 18.7 mt -87.82 119.91 70.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.077 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -67.22 170.18 13.8 Favored 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 122.728 2.285 . . . . 0.0 112.339 169.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -49.69 131.78 29.54 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.828 3.019 . . . . 0.0 114.157 173.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.77 -5.88 80.37 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 124.501 1.048 . . . . 0.0 115.575 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -83.05 136.49 34.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.655 1.228 . . . . 0.0 111.68 174.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.3 163.15 40.03 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.208 0.603 . . . . 0.0 111.456 169.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -49.97 142.81 8.68 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.639 2.376 . . . . 0.0 113.448 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.22 171.71 16.5 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.518 2.327 . . . . 0.0 109.92 -174.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.63 140.03 17.73 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.531 0.681 . . . . 0.0 112.381 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.417 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 72.8 m-85 -84.09 147.2 27.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.218 1.407 . . . . 0.0 110.082 173.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -18.31 46.08 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -68.44 -12.87 61.8 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.634 1.174 . . . . 0.0 113.778 170.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.81 68.98 1.41 Allowed Glycine 0 CA--C 1.53 1.003 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 -169.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.4 m -151.74 122.57 7.52 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.677 -1.484 . . . . 0.0 109.166 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -94.77 141.6 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.723 0.809 . . . . 0.0 110.248 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -148.99 -174.52 4.66 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.403 1.881 . . . . 0.0 109.344 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -125.57 139.6 53.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.276 1.03 . . . . 0.0 109.621 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -135.6 128.59 31.45 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.935 1.294 . . . . 0.0 111.27 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -75.26 94.4 2.99 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.693 1.997 . . . . 0.0 110.851 170.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.256 1.9 p-80 -76.7 29.97 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -116.43 -22.37 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 125.662 1.585 . . . . 0.0 109.374 169.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -137.8 -17.08 1.27 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 80.08 -1.97 2.02 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 129.322 3.049 . . . . 0.0 113.976 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.66 129.57 39.68 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.549 1.068 . . . . 0.0 109.078 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.1 139.51 22.44 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.843 -0.535 . . . . 0.0 112.053 -169.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -163.88 167.93 20.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.435 1.494 . . . . 0.0 110.41 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -78.85 4.99 12.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.895 1.278 . . . . 0.0 113.287 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -51.64 109.58 0.37 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.351 1.86 . . . . 0.0 110.514 172.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.9 ttt-85 -98.79 152.1 37.69 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.516 1.526 . . . . 0.0 110.38 -171.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_exo -49.63 -73.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 123.822 3.015 . . . . 0.0 116.241 -170.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.6 m -179.06 174.01 1.11 Allowed 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 130.366 3.466 . . . . 0.0 109.847 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.107 -1.385 . . . . 0.0 112.013 -174.708 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.417 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.9 pttm . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 pp -161.65 157.53 21.17 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-O 118.574 -0.727 . . . . 0.0 112.242 -169.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -86.63 168.0 8.51 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.024 3.149 . . . . 0.0 113.211 177.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.37 140.19 15.78 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.628 3.552 . . . . 0.0 114.103 169.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.24 -37.4 3.63 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.183 1.373 . . . . 0.0 111.471 -174.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -78.45 114.5 17.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.048 1.339 . . . . 0.0 110.335 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -119.88 139.5 52.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.937 0.895 . . . . 0.0 111.49 -171.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -56.99 123.11 14.0 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.771 1.629 . . . . 0.0 111.719 -173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.38 167.47 21.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.096 2.158 . . . . 0.0 111.389 -169.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -154.63 130.15 9.86 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.079 0.552 . . . . 0.0 111.17 -169.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -87.89 133.49 33.9 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.913 1.685 . . . . 0.0 109.783 173.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.91 -19.51 12.35 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 173.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.88 -9.79 10.99 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 127.827 2.451 . . . . 0.0 112.714 169.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' C ' ' HG1' ' A' ' 15' ' ' THR . . . 84.45 59.94 1.96 Allowed Glycine 0 C--N 1.34 0.805 0 C-N-CA 125.129 1.347 . . . . 0.0 110.951 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.401 ' HG1' ' C ' ' A' ' 14' ' ' GLY . 92.1 m -152.44 122.16 6.93 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.673 -1.487 . . . . 0.0 110.451 179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.0 t -94.86 143.57 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.986 0.914 . . . . 0.0 110.139 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -152.96 -179.28 7.53 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 126.154 1.782 . . . . 0.0 109.263 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -120.11 140.18 51.46 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.836 1.254 . . . . 0.0 109.564 170.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -123.28 117.05 24.39 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.024 0.93 . . . . 0.0 110.201 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -71.23 91.15 0.94 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.907 0.883 . . . . 0.0 109.947 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -72.3 8.18 1.45 Allowed 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.3 mt -93.7 -21.51 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.69 1.196 . . . . 0.0 110.451 170.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.8 p -138.2 -18.0 1.17 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -170.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 80.05 2.4 2.03 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.751 3.221 . . . . 0.0 113.9 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 129.9 41.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.078 1.308 . . . . 0.0 112.114 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 98.7 p -112.4 127.52 56.05 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.126 -0.984 . . . . 0.0 112.215 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -122.56 124.63 43.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.929 1.691 . . . . 0.0 110.152 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -80.62 -30.79 36.72 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.69 109.13 10.2 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 122.012 0.911 . . . . 0.0 108.967 -175.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 154.17 80.85 Favored Pre-proline 0 N--CA 1.473 0.697 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -169.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -84.11 -175.13 2.09 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.477 3.451 . . . . 0.0 110.344 169.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.4 p -75.34 65.49 1.65 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.347 -0.845 . . . . 0.0 109.766 169.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.263 0 C-N-CA 125.0 1.286 . . . . 0.0 112.785 -172.973 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.441 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 119.407 -0.33 . . . . 0.0 111.834 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.407 HD21 ' CD2' ' A' ' 18' ' ' TYR . 3.1 pp -153.65 152.66 27.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.011 0.924 . . . . 0.0 110.525 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -83.79 165.45 13.65 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.217 2.611 . . . . 0.0 112.048 175.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -60.25 140.21 90.9 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.177 2.585 . . . . 0.0 112.493 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 106.17 -21.26 33.8 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.146 1.355 . . . . 0.0 113.654 -177.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.14 107.23 17.11 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.61 1.164 . . . . 0.0 109.999 171.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -119.92 149.65 41.76 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.038 0.935 . . . . 0.0 111.432 -169.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 118.41 5.04 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 128.465 2.706 . . . . 0.0 112.692 -171.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -133.48 168.2 19.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.924 2.089 . . . . 0.0 110.633 -172.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 24.8 ttt -154.72 131.97 11.08 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.885 -0.509 . . . . 0.0 111.379 -169.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -83.71 156.02 22.81 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.354 1.462 . . . . 0.0 111.08 178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.82 -16.08 56.83 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -83.94 -1.85 55.4 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.435 1.094 . . . . 0.0 113.435 170.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.98 11.38 53.23 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.867 1.222 . . . . 0.0 115.234 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.0 m -94.82 122.68 37.7 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.558 1.679 . . . . 0.0 109.931 -169.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -94.65 142.59 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-O 121.758 0.79 . . . . 0.0 110.49 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -152.54 179.89 8.19 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.538 1.935 . . . . 0.0 109.454 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.407 ' CD2' HD21 ' A' ' 2' ' ' LEU . 28.7 m-85 -116.34 137.94 51.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 122.332 1.063 . . . . 0.0 111.237 171.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -124.34 119.26 28.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.959 1.704 . . . . 0.0 109.779 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.0 95.56 0.96 Allowed 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.231 1.012 . . . . 0.0 110.778 175.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -71.24 9.7 0.71 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -178.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.74 -20.8 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 125.141 1.377 . . . . 0.0 110.593 173.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -138.67 -5.61 1.54 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.087 1.355 . . . . 0.0 114.536 -171.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.322 0.2 OUTLIER 58.02 16.76 3.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.95 2.1 . . . . 0.0 114.706 -169.473 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.6 155.3 39.46 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 119.586 1.085 . . . . 0.0 110.704 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.6 p -147.95 128.43 14.04 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.219 -0.926 . . . . 0.0 112.505 -173.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -146.02 161.98 38.91 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.492 0.717 . . . . 0.0 112.638 174.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -85.51 -10.16 56.41 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.97 149.78 49.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.165 0.893 . . . . 0.0 111.575 171.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 162.33 55.15 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 127.641 2.376 . . . . 0.0 112.987 -169.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -49.84 171.39 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.696 2.931 . . . . 0.0 113.799 172.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 54.1 p 68.17 -171.93 0.19 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.394 1.478 . . . . 0.0 110.555 -169.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.271 0 C-N-CA 124.878 1.228 . . . . 0.0 114.301 -174.55 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.449 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.488 ' H3 ' ' C ' ' A' ' 33' ' ' GLY . 53.1 tttp . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 116.366 -1.778 . . . . 0.0 111.523 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.3 tp -53.37 119.65 18.34 Favored Pre-proline 0 CA--C 1.55 0.944 0 CA-C-N 120.305 1.411 . . . . 0.0 111.355 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.53 157.44 58.87 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 122.085 1.856 . . . . 0.0 112.971 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.55 132.55 25.64 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.38 2.72 . . . . 0.0 112.725 -172.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.13 1.45 90.35 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 118.835 -0.981 . . . . 0.0 114.768 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -90.04 131.74 35.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.839 1.32 . . . . 0.0 110.517 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' CD ' ' HZ1' ' A' ' 8' ' ' LYS . 0.7 OUTLIER -128.17 141.13 51.56 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.089 1.756 . . . . 0.0 109.908 -169.565 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.446 ' HZ1' ' CD ' ' A' ' 7' ' ' GLU . 0.0 OUTLIER -72.37 143.81 48.45 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.863 -1.148 . . . . 0.0 112.928 -171.476 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.9 tpp85 -150.14 172.33 15.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.817 1.247 . . . . 0.0 111.561 -171.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.6 ttp -154.84 133.63 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.867 0.867 . . . . 0.0 110.154 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.419 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 55.0 m-85 -72.44 159.82 33.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.004 0.522 . . . . 0.0 111.55 176.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.14 -17.87 59.18 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -84.78 -0.31 53.35 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.903 1.281 . . . . 0.0 113.611 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.14 11.64 51.83 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 125.076 1.322 . . . . 0.0 115.099 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 m -94.85 99.45 11.5 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.061 1.931 . . . . 0.0 110.553 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.4 t -46.01 136.61 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.94 1.696 . . . . 0.0 114.266 169.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -151.95 179.44 8.46 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.636 1.174 . . . . 0.0 110.475 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -116.17 139.35 50.42 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.182 1.393 . . . . 0.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -123.23 114.84 20.79 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.681 1.992 . . . . 0.0 109.585 -169.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -68.84 101.01 1.26 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.827 0.851 . . . . 0.0 110.972 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -71.22 0.48 7.79 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.1 mt -94.04 -20.2 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.358 1.063 . . . . 0.0 110.565 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -135.19 -20.44 1.66 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 79.98 3.7 2.0 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 128.923 2.889 . . . . 0.0 113.514 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.24 136.76 57.91 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.796 1.18 . . . . 0.0 111.469 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.3 p -125.96 122.8 37.0 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.193 0.997 . . . . 0.0 111.636 -174.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -134.96 148.37 49.99 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.0 0.92 . . . . 0.0 112.166 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -75.93 5.18 6.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.693 1.197 . . . . 0.0 113.998 174.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -54.84 109.92 0.58 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.87 1.268 . . . . 0.0 109.248 169.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.1 ttp-105 -110.56 112.11 56.76 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.237 1.015 . . . . 0.0 109.665 -175.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.34 178.94 5.51 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.815 3.01 . . . . 0.0 112.963 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.3 m -155.55 32.76 0.37 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.078 1.751 . . . . 0.0 109.453 169.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.488 ' C ' ' H3 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.255 1.423 0 C-N-CA 127.753 2.597 . . . . 0.0 110.125 -169.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.419 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 18' ' ' TYR . 2.8 pp -158.48 139.65 9.55 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.652 1.581 . . . . 0.0 110.098 169.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -81.37 172.36 12.71 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.911 3.074 . . . . 0.0 112.781 175.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -59.66 140.23 92.62 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.025 2.483 . . . . 0.0 111.337 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 -21.4 21.29 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.183 1.373 . . . . 0.0 112.505 -170.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -90.32 150.44 21.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.302 1.441 . . . . 0.0 111.031 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -145.12 152.27 39.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.272 1.029 . . . . 0.0 111.215 171.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 pttm -61.4 136.23 57.96 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.24 1.816 . . . . 0.0 111.62 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -145.51 173.96 11.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.146 1.378 . . . . 0.0 110.707 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttm -154.39 140.02 17.95 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.384 1.474 . . . . 0.0 108.849 -177.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -83.06 161.95 21.52 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.133 1.773 . . . . 0.0 111.449 176.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.87 -7.5 5.23 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 p30 -99.4 0.93 43.73 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.693 1.597 . . . . 0.0 113.145 172.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.01 12.34 56.6 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.553 1.073 . . . . 0.0 115.303 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.7 m -94.8 124.27 38.74 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.645 1.722 . . . . 0.0 109.477 -170.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.0 t -94.67 139.6 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.748 0.819 . . . . 0.0 110.954 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -153.65 -172.85 4.36 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.203 1.801 . . . . 0.0 110.16 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' A' ' 2' ' ' LEU . 54.7 m-85 -124.53 137.89 54.38 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.968 1.307 . . . . 0.0 110.195 173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -125.95 126.2 43.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.3 1.44 . . . . 0.0 110.224 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -80.97 94.89 6.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.664 0.785 . . . . 0.0 110.244 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -71.87 6.15 2.2 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.9 mm -95.58 -21.7 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.448 1.099 . . . . 0.0 111.304 170.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.9 p -136.75 -11.66 1.78 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -169.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 69.69 11.11 7.82 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.909 1.683 . . . . 0.0 113.546 -169.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 157.73 31.36 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 120.092 1.315 . . . . 0.0 111.899 169.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -147.93 134.81 20.12 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.274 -0.891 . . . . 0.0 112.106 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -135.23 148.86 49.74 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.211 1.404 . . . . 0.0 110.642 177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -82.35 -14.18 55.7 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 170.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -66.27 140.53 58.14 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.199 0.999 . . . . 0.0 112.08 177.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.02 160.53 32.0 Favored Pre-proline 0 CA--C 1.542 0.645 0 C-N-CA 128.467 2.707 . . . . 0.0 114.504 -169.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.22 174.13 0.19 Allowed 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.517 3.478 . . . . 0.0 115.692 170.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.9 m 66.04 74.37 0.36 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 127.652 2.381 . . . . 0.0 113.488 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 C-N-CA 124.242 0.925 . . . . 0.0 111.363 -173.156 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.444 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 mtmm . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 90.2 mt -141.85 119.66 7.57 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 119.475 1.034 . . . . 0.0 111.359 169.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -73.63 176.06 9.85 Favored 'Trans proline' 0 CA--C 1.551 1.372 0 C-N-CA 122.993 2.462 . . . . 0.0 111.277 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -48.71 120.54 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.159 3.239 . . . . 0.0 114.538 173.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.51 1.0 83.91 Favored Glycine 0 CA--C 1.533 1.214 0 N-CA-C 115.951 1.141 . . . . 0.0 115.951 172.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -86.44 123.38 31.6 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.348 1.574 . . . . 0.0 111.532 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -144.79 160.83 40.62 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.77 132.29 51.76 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -169.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.39 168.95 19.27 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.986 1.714 . . . . 0.0 109.956 -176.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.8 ttp -154.72 140.05 17.67 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.388 -0.82 . . . . 0.0 111.598 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -83.32 161.49 21.41 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.331 1.053 . . . . 0.0 111.458 172.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.23 -25.77 48.77 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -68.8 19.4 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.531 1.933 . . . . 0.0 113.849 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 48.07 30.53 7.5 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.303 1.43 . . . . 0.0 113.463 -170.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.3 m -101.84 112.25 24.8 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 123.634 0.773 . . . . 0.0 108.951 -169.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.6 t -94.5 132.32 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.837 0.855 . . . . 0.0 110.272 -169.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -141.96 179.67 6.74 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.423 1.889 . . . . 0.0 109.795 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -118.14 134.76 54.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.943 0.878 . . . . 0.0 110.136 176.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -121.94 130.61 53.47 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.127 1.771 . . . . 0.0 110.705 -169.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -82.72 101.44 10.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.436 0.694 . . . . 0.0 111.013 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -68.53 -4.91 16.82 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.2 mt -92.6 -19.91 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.443 1.097 . . . . 0.0 110.694 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.7 p -136.7 -11.06 1.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -170.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 66.55 12.53 8.8 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.177 1.391 . . . . 0.0 113.136 -170.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.88 33.27 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.467 -1.395 . . . . 0.0 111.454 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.4 p -151.14 129.78 12.28 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.162 -0.961 . . . . 0.0 111.918 -175.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -142.04 152.56 43.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.664 1.185 . . . . 0.0 112.302 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.79 -5.7 59.21 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -64.24 147.7 51.82 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.673 1.124 . . . . 0.0 109.548 169.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -129.96 160.28 65.95 Favored Pre-proline 0 N--CA 1.47 0.547 0 C-N-CA 124.755 1.222 . . . . 0.0 109.683 -171.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -52.14 -28.01 31.68 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.548 2.832 . . . . 0.0 117.602 -171.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -76.79 -1.36 27.74 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 129.506 3.123 . . . . 0.0 116.745 -170.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.226 0 CA-C-N 120.307 1.412 . . . . 0.0 113.685 -179.501 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.426 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.478 ' H3 ' ' C ' ' A' ' 33' ' ' GLY . 84.9 tttt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.067 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 34.1 tp -59.56 119.65 41.88 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.935 1.294 . . . . 0.0 111.507 -171.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -88.91 165.98 5.87 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.304 2.669 . . . . 0.0 113.152 -174.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -58.28 140.07 92.97 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.145 2.563 . . . . 0.0 113.248 -177.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.4 -18.14 15.78 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 118.263 -1.298 . . . . 0.0 114.175 -173.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -89.97 113.48 25.14 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 119.152 1.476 . . . . 0.0 110.387 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.88 165.01 33.85 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.82 145.32 7.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.952 1.301 . . . . 0.0 114.384 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.14 167.76 25.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.711 2.405 . . . . 0.0 110.222 -169.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 59.9 ttp -154.64 126.81 7.78 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.291 0.567 . . . . 0.0 112.358 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.415 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 73.6 m-85 -75.73 129.28 36.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.763 1.625 . . . . 0.0 109.589 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.19 -27.54 67.23 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -72.23 5.69 2.68 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.774 1.63 . . . . 0.0 113.691 169.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.87 62.54 0.97 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 125.26 1.41 . . . . 0.0 114.204 169.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.0 m -152.41 121.93 6.84 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.322 1.561 . . . . 0.0 111.865 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 38.5 t -94.66 138.21 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.512 1.125 . . . . 0.0 109.582 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -150.65 179.59 8.06 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.211 1.804 . . . . 0.0 109.772 -177.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.401 ' CE1' ' HA ' ' A' ' 30' ' ' ARG . 13.0 m-85 -111.16 135.07 52.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.687 1.195 . . . . 0.0 112.148 169.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -130.95 136.42 48.54 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.554 1.142 . . . . 0.0 111.938 -174.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -88.84 98.86 11.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.662 0.785 . . . . 0.0 110.618 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -76.04 25.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.4 mt -122.45 -40.01 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.127 1.371 . . . . 0.0 109.803 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -101.23 -22.11 14.73 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 79.58 8.01 1.75 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.05 2.94 . . . . 0.0 114.013 -170.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.16 153.28 30.67 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.256 0.935 . . . . 0.0 112.09 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -142.74 150.19 39.75 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.273 1.029 . . . . 0.0 112.232 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.37 136.29 32.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.601 1.161 . . . . 0.0 110.931 174.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -84.94 5.15 30.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.104 0.961 . . . . 0.0 113.503 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -80.55 153.6 27.98 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.247 2.219 . . . . 0.0 107.901 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HA ' ' CE1' ' A' ' 18' ' ' TYR . 31.6 mtt85 -130.03 89.59 45.05 Favored Pre-proline 0 N--CA 1.472 0.662 0 O-C-N 121.587 -0.696 . . . . 0.0 110.688 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -95.2 -176.06 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 124.809 3.673 . . . . 0.0 111.422 178.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 24.8 t -139.02 13.82 2.65 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 172.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' C ' ' H3 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.252 1.271 0 C-N-CA 124.456 1.027 . . . . 0.0 112.496 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.415 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.413 ' HZ2' ' C ' ' A' ' 33' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.301 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pp -146.01 155.68 51.26 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.031 0.832 . . . . 0.0 112.525 174.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -70.63 168.31 23.08 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.231 2.621 . . . . 0.0 113.978 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -49.76 140.19 30.44 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.148 3.232 . . . . 0.0 114.082 169.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.5 -15.57 40.08 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-O 118.349 -1.251 . . . . 0.0 115.306 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -74.45 104.97 5.37 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.876 1.338 . . . . 0.0 109.115 170.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.96 149.88 49.63 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 110.81 -169.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -59.43 138.01 57.81 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.906 1.682 . . . . 0.0 114.38 -169.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.85 -175.73 4.24 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.585 1.954 . . . . 0.0 110.642 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 46.3 mtt -154.32 130.36 10.26 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.82 2.048 . . . . 0.0 109.227 -177.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -77.37 159.44 29.49 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.329 1.051 . . . . 0.0 110.937 170.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.92 -12.09 22.91 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -178.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -91.38 0.1 57.56 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.392 1.477 . . . . 0.0 113.212 171.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.19 15.19 52.44 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 124.914 1.245 . . . . 0.0 115.106 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 53.1 m -94.81 125.32 39.39 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 119.574 1.687 . . . . 0.0 109.617 -170.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 t -94.45 138.24 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.683 0.793 . . . . 0.0 109.245 -171.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.04 179.63 7.6 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.988 1.315 . . . . 0.0 109.386 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -118.05 143.03 46.77 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.746 1.218 . . . . 0.0 110.853 170.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -129.89 122.11 27.99 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.801 1.64 . . . . 0.0 109.241 -170.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -72.28 91.39 1.31 Allowed 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 110.379 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.264 1.5 p-80 -73.88 26.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 177.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.9 mt -114.13 -20.12 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 126.011 1.724 . . . . 0.0 109.633 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.1 p -134.73 -21.28 1.72 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.227 1.411 . . . . 0.0 114.623 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 80.08 8.54 1.48 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.538 2.735 . . . . 0.0 114.018 -169.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.74 152.88 43.28 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.115 1.325 . . . . 0.0 111.461 172.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.9 p -147.06 138.23 23.95 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.213 -0.929 . . . . 0.0 112.64 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -150.03 153.55 36.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.562 0.745 . . . . 0.0 111.296 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -75.12 -10.48 59.51 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -65.77 148.58 51.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.748 0.819 . . . . 0.0 111.595 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.97 160.17 66.48 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 126.741 2.016 . . . . 0.0 112.148 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.68 -51.6 9.43 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.928 3.085 . . . . 0.0 117.061 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.2 p -65.28 81.0 0.05 Allowed 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 128.832 2.853 . . . . 0.0 114.287 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.413 ' C ' ' HZ2' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.248 0.97 0 C-N-CA 124.611 1.1 . . . . 0.0 111.597 176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.464 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.415 ' HZ2' ' CD ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.3 pp -163.01 154.32 14.74 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.09 1.756 . . . . 0.0 109.613 169.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -88.82 170.09 5.29 Favored 'Trans proline' 0 CA--C 1.55 1.283 0 C-N-CA 123.434 2.756 . . . . 0.0 112.485 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.82 140.26 13.14 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.108 3.206 . . . . 0.0 114.004 170.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.19 -14.3 61.26 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.351 0.976 . . . . 0.0 114.563 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 44.8 m95 -90.0 116.19 27.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.696 1.198 . . . . 0.0 108.106 169.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -119.87 141.02 49.95 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.183 1.393 . . . . 0.0 111.288 -169.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 125.28 25.73 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.376 0.671 . . . . 0.0 111.58 -169.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.32 171.25 13.96 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.239 2.216 . . . . 0.0 110.975 -169.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.57 140.21 17.96 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.403 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 60.9 m-85 -79.56 156.32 27.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.194 1.398 . . . . 0.0 111.107 174.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.01 -16.01 58.37 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.6 p30 -83.24 -0.92 51.66 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.694 1.197 . . . . 0.0 113.327 170.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.81 13.77 52.07 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.916 1.246 . . . . 0.0 114.883 -178.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.1 m -94.79 119.26 33.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.61 1.705 . . . . 0.0 109.425 -170.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t -94.48 141.14 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-O 122.066 0.936 . . . . 0.0 110.008 -172.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -154.41 179.97 8.5 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.991 1.717 . . . . 0.0 109.256 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -117.85 140.46 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.542 1.137 . . . . 0.0 109.892 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -125.89 120.37 30.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.043 1.337 . . . . 0.0 110.599 -169.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -73.28 97.33 2.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.806 0.842 . . . . 0.0 110.71 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -71.43 3.28 3.93 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.9 mp -96.89 -23.64 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 110.758 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -130.52 -20.68 2.91 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 78.28 6.72 2.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.227 2.611 . . . . 0.0 113.53 -169.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.95 156.5 27.65 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.651 1.114 . . . . 0.0 111.383 172.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -144.14 150.03 37.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.382 -0.824 . . . . 0.0 112.734 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -143.65 119.76 10.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.193 1.397 . . . . 0.0 109.666 -176.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -66.43 -35.74 81.06 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.415 ' CD ' ' HZ2' ' A' ' 1' ' ' LYS . 4.4 tt0 -61.05 141.04 57.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.828 1.251 . . . . 0.0 111.12 174.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.1 mtm105 -104.69 160.78 24.87 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.65 1.58 . . . . 0.0 112.811 -169.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -49.89 -43.1 42.63 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 124.295 3.33 . . . . 0.0 115.723 -173.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.0 m 142.86 -18.73 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.167 1 C-N-CA 133.939 4.895 . . . . 0.0 111.919 -176.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 C-N-CA 126.206 1.86 . . . . 0.0 110.312 169.88 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.444 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 82.9 tttt . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.51 119.86 31.93 Favored Pre-proline 0 CA--C 1.549 0.921 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.154 170.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.86 174.49 4.6 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 123.227 2.618 . . . . 0.0 113.857 176.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.76 129.6 17.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.969 3.112 . . . . 0.0 114.222 173.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.81 4.15 85.0 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.413 -1.215 . . . . 0.0 115.88 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -85.3 129.35 34.83 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.37 1.585 . . . . 0.0 111.731 173.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -123.29 158.63 30.53 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.841 2.057 . . . . 0.0 111.75 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.89 118.04 20.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.224 1.409 . . . . 0.0 109.223 170.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 tpp85 -125.38 170.41 11.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.343 1.857 . . . . 0.0 110.425 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -154.69 140.17 17.81 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.303 -0.873 . . . . 0.0 112.818 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -76.28 133.26 40.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.512 1.925 . . . . 0.0 109.714 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.02 -28.48 69.08 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -73.18 5.89 3.18 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.937 1.695 . . . . 0.0 113.748 170.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.11 64.77 1.08 Allowed Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.223 1.392 . . . . 0.0 114.794 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.1 m -153.08 132.12 12.59 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.435 1.617 . . . . 0.0 110.893 169.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.6 t -94.62 143.3 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.889 0.875 . . . . 0.0 109.937 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -149.69 -177.35 5.83 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.238 1.415 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.11 130.67 53.45 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.738 1.215 . . . . 0.0 108.98 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -124.91 140.03 53.3 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.245 1.418 . . . . 0.0 111.336 -169.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.54 104.41 16.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.358 0.663 . . . . 0.0 111.539 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -2.26 14.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.7 mm -91.55 -23.96 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.903 0.881 . . . . 0.0 111.447 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.1 p -133.6 -11.17 2.75 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -169.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 66.38 13.27 9.15 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.914 1.286 . . . . 0.0 113.101 -169.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.39 156.65 31.58 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.71 -1.244 . . . . 0.0 111.291 169.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.0 p -150.84 139.92 21.09 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.489 -0.757 . . . . 0.0 112.082 -178.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -136.67 155.77 49.44 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.111 1.364 . . . . 0.0 110.642 174.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -88.5 -17.48 30.22 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 171.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.35 131.46 45.36 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.166 0.894 . . . . 0.0 111.945 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.89 160.42 30.16 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 127.554 2.342 . . . . 0.0 113.473 -171.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.4 ' C ' ' HG ' ' A' ' 32' ' ' SER . 84.9 Cg_exo -49.91 162.78 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.167 3.244 . . . . 0.0 115.879 177.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.4 ' HG ' ' C ' ' A' ' 31' ' ' PRO . 3.1 m -162.7 21.58 0.09 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.491 1.516 . . . . 0.0 110.874 175.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 C-N-CA 127.608 2.528 . . . . 0.0 107.819 -169.321 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 22.6 tp -55.91 119.85 29.17 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.599 1.16 . . . . 0.0 110.141 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -80.08 159.91 23.73 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.686 2.257 . . . . 0.0 113.876 -169.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -47.14 132.33 18.32 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.338 3.358 . . . . 0.0 114.419 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.66 -14.1 20.05 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 118.36 -1.245 . . . . 0.0 115.431 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -90.44 142.0 28.18 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.426 1.613 . . . . 0.0 112.629 169.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -136.88 158.13 45.15 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.772 0.796 . . . . 0.0 112.335 169.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -77.4 137.05 38.48 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.092 1.357 . . . . 0.0 110.495 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.45 169.34 17.87 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.007 1.323 . . . . 0.0 111.393 -171.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 42.1 ttp -154.66 138.42 16.18 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.193 0.521 . . . . 0.0 111.432 -179.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -74.21 136.43 42.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.464 1.506 . . . . 0.0 109.691 169.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.77 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -72.89 6.14 2.79 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.659 1.984 . . . . 0.0 114.075 170.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.99 67.34 1.17 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.541 1.543 . . . . 0.0 114.86 169.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 m -153.25 129.6 10.56 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.374 1.587 . . . . 0.0 110.793 169.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.7 t -94.63 141.68 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.943 0.897 . . . . 0.0 110.139 -173.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -149.1 179.86 7.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.171 1.388 . . . . 0.0 110.742 178.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -114.88 133.19 56.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.548 1.539 . . . . 0.0 110.703 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -123.02 116.21 23.15 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.042 1.737 . . . . 0.0 109.031 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -74.39 97.32 3.03 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.511 0.724 . . . . 0.0 110.086 174.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -69.58 3.35 2.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.3 mt -95.43 -20.1 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 119.25 0.932 . . . . 0.0 110.978 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -134.11 -20.04 1.94 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -171.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 79.04 5.92 2.22 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 129.161 2.984 . . . . 0.0 113.154 -169.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.32 129.86 41.59 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.86 1.209 . . . . 0.0 111.253 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.5 p -120.41 123.3 42.71 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.144 0.977 . . . . 0.0 111.769 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -133.11 146.32 51.51 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 110.235 179.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -81.87 -30.78 31.84 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.69 -0.631 . . . . 0.0 111.353 177.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.4 109.63 0.52 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.751 2.42 . . . . 0.0 110.27 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -72.68 110.41 8.21 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 124.747 1.219 . . . . 0.0 112.452 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -85.65 62.14 5.45 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.781 2.321 . . . . 0.0 112.747 -176.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.1 p 56.23 29.73 15.36 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 112.56 -2.109 . . . . 0.0 115.458 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.035 0 C-N-CA 125.693 1.616 . . . . 0.0 111.732 178.538 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 46.2 tp -57.55 119.67 34.6 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.711 0.804 . . . . 0.0 111.715 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -73.26 154.84 51.67 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 122.335 2.023 . . . . 0.0 113.122 175.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.37 130.39 21.02 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.394 2.729 . . . . 0.0 112.042 -175.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.95 -10.85 62.29 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.824 1.202 . . . . 0.0 114.267 -177.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -89.77 136.36 33.08 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 1.279 . . . . 0.0 111.458 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -133.57 137.03 45.3 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.958 1.703 . . . . 0.0 111.118 -169.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 140.23 54.31 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -169.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -144.23 176.26 9.47 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 127.451 2.301 . . . . 0.0 111.717 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 16.3 ttt -154.63 122.2 5.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.103 1.361 . . . . 0.0 109.35 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -70.0 159.33 33.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.81 1.244 . . . . 0.0 111.307 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.95 -16.19 58.5 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.0 p30 -85.91 -1.37 57.23 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.672 1.189 . . . . 0.0 113.312 170.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.78 14.38 49.93 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.45 1.5 . . . . 0.0 115.239 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.6 m -94.96 123.35 38.39 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.762 1.781 . . . . 0.0 109.705 -170.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.8 t -94.51 136.64 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 121.631 0.729 . . . . 0.0 109.589 -172.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -143.85 179.61 7.06 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.101 1.36 . . . . 0.0 109.822 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -122.76 143.52 49.77 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.096 1.359 . . . . 0.0 109.234 172.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -124.28 119.52 29.54 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.724 1.61 . . . . 0.0 110.633 -169.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -64.52 101.55 0.46 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.366 0.667 . . . . 0.0 109.992 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -75.41 3.64 8.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -97.46 -32.74 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.473 1.509 . . . . 0.0 110.214 174.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 32.0 p -119.09 -18.12 8.8 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 80.01 1.38 2.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 129.245 3.018 . . . . 0.0 114.38 -170.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.77 129.67 40.61 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.975 1.261 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.6 p -112.68 124.43 52.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.998 1.319 . . . . 0.0 111.541 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -141.11 150.33 42.72 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.868 0.842 . . . . 0.0 111.95 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -77.81 5.27 9.86 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.43 1.892 . . . . 0.0 113.8 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -75.15 109.66 8.83 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.187 -0.945 . . . . 0.0 110.801 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.36 160.43 28.44 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.916 1.687 . . . . 0.0 114.008 -169.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -52.91 169.59 0.36 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 125.02 3.813 . . . . 0.0 114.939 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.0 m 63.35 -31.41 0.1 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 128.169 2.588 . . . . 0.0 117.265 175.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.38 1.467 . . . . 0.0 111.422 178.497 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.443 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 62.04 153.65 0.11 Allowed Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.493 3.117 . . . . 0.0 115.159 -171.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -60.74 165.86 11.05 Favored 'Trans proline' 0 CA--C 1.552 1.378 0 C-N-CA 123.339 2.692 . . . . 0.0 113.792 172.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -43.74 101.47 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 1 C-N-CA 125.638 4.226 . . . . 0.0 116.379 -174.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.53 -5.97 84.16 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.067 1.318 . . . . 0.0 115.58 175.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -80.18 143.08 34.12 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.923 1.361 . . . . 0.0 112.101 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -157.6 160.57 38.24 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 110.302 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 144.48 52.52 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.366 1.867 . . . . 0.0 112.129 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -140.05 173.5 11.46 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.4 1.48 . . . . 0.0 111.617 171.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.7 ttt -154.69 117.25 4.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.571 1.548 . . . . 0.0 109.418 -178.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -67.59 156.95 35.58 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.69 1.196 . . . . 0.0 111.451 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -16.18 58.0 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -84.84 -1.53 56.58 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.627 1.171 . . . . 0.0 113.299 170.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.0 13.55 49.15 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 125.273 1.416 . . . . 0.0 115.274 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.7 m -94.88 119.63 33.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.694 1.747 . . . . 0.0 109.885 -169.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -94.43 140.34 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.898 0.856 . . . . 0.0 109.911 -173.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -151.12 179.9 7.88 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.381 1.472 . . . . 0.0 109.904 -177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -119.69 143.46 47.74 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.85 0.86 . . . . 0.0 109.594 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -131.52 140.06 49.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.631 1.572 . . . . 0.0 109.529 -173.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -98.38 94.96 7.03 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.681 0.792 . . . . 0.0 110.083 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.283 1.6 p-80 -74.82 20.18 0.13 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -178.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.4 mt -112.19 -17.66 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 C-N-CA 125.516 1.527 . . . . 0.0 110.183 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.8 p -135.18 -11.5 2.2 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -175.209 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.3 11.67 8.51 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.067 1.747 . . . . 0.0 113.659 -169.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.62 155.84 31.99 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.129 1.332 . . . . 0.0 111.869 170.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.8 p -150.55 140.48 21.93 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.05 0.94 . . . . 0.0 111.944 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -145.03 140.13 27.91 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.837 0.855 . . . . 0.0 112.799 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -77.74 -33.56 52.84 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.261 1.025 . . . . 0.0 112.299 170.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -61.76 109.74 1.31 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.226 1.01 . . . . 0.0 109.731 173.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -63.09 117.06 29.42 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -77.1 -177.52 3.89 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.929 3.086 . . . . 0.0 110.166 171.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 38.2 m -157.73 161.75 38.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.422 -1.424 . . . . 0.0 111.167 171.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 C-N-CA 127.053 2.263 . . . . 0.0 109.858 -173.321 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.483 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.487 ' H1 ' ' CD ' ' A' ' 7' ' ' GLU . 4.6 ttpp . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.708 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.3 mt -157.4 165.17 19.34 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 125.638 1.575 . . . . 0.0 110.92 169.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.76 139.89 48.19 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 123.561 2.84 . . . . 0.0 113.842 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -43.62 103.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.465 4.11 . . . . 0.0 115.675 -176.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 129.95 -41.77 1.5 Allowed Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.128 1.347 . . . . 0.0 112.567 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.62 151.26 21.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.265 1.033 . . . . 0.0 112.463 169.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.487 ' CD ' ' H1 ' ' A' ' 1' ' ' LYS . 3.3 mm-40 -149.31 160.17 43.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 169.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.404 ' HZ1' ' C ' ' A' ' 33' ' ' GLY . 20.8 ttmm -78.47 133.04 37.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.819 1.247 . . . . 0.0 110.132 174.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -128.36 177.94 6.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.899 2.08 . . . . 0.0 109.909 175.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -154.42 138.46 16.42 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.723 0.809 . . . . 0.0 111.159 170.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -76.68 138.1 39.81 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.678 1.591 . . . . 0.0 110.616 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.59 -24.41 65.44 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 122.613 0.365 . . . . 0.0 111.762 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -69.8 0.24 6.03 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 127.178 2.191 . . . . 0.0 113.092 169.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 85.84 60.65 1.75 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 124.671 1.129 . . . . 0.0 113.28 169.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 16.1 m -156.42 135.65 12.11 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.993 -1.298 . . . . 0.0 110.469 173.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -94.59 141.88 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 124.355 1.062 . . . . 0.0 108.711 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -149.55 179.5 7.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.713 0.768 . . . . 0.0 111.023 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -126.05 110.94 14.12 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 126.131 1.772 . . . . 0.0 110.891 -173.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -109.99 126.04 53.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 126.092 1.757 . . . . 0.0 111.816 -169.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -77.3 103.35 7.18 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.923 0.889 . . . . 0.0 109.148 169.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -75.93 15.22 0.56 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.2 mt -112.11 -39.99 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.003 1.321 . . . . 0.0 110.329 169.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.7 p -105.31 -20.0 13.63 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -177.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 79.46 2.79 2.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.821 2.848 . . . . 0.0 114.323 -171.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 129.96 44.3 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.605 1.093 . . . . 0.0 111.923 176.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -123.75 119.27 29.26 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.055 1.342 . . . . 0.0 111.438 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -119.74 144.2 47.39 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.068 0.947 . . . . 0.0 111.004 -176.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -90.22 -23.41 21.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.157 0.583 . . . . 0.0 111.012 170.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.45 109.75 0.43 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.919 2.488 . . . . 0.0 109.085 170.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -84.22 111.84 36.69 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 124.466 1.107 . . . . 0.0 112.414 -169.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -78.06 -138.0 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.78 3.653 . . . . 0.0 110.688 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.4 p -69.5 63.34 0.17 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.982 1.713 . . . . 0.0 113.88 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' C ' ' HZ1' ' A' ' 8' ' ' LYS . . . . . . . . 0 C--O 1.249 1.036 0 C-N-CA 127.136 2.303 . . . . 0.0 114.357 171.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.485 ' H3 ' ' C ' ' A' ' 33' ' ' GLY . 18.9 tptm . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 118.051 -0.976 . . . . 0.0 111.699 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 35.1 tp -56.27 119.5 28.15 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 124.763 1.225 . . . . 0.0 110.972 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.73 169.25 19.91 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.53 2.153 . . . . 0.0 112.646 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -64.08 140.03 69.94 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.733 2.289 . . . . 0.0 112.732 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.75 -13.57 52.29 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.372 -1.238 . . . . 0.0 114.9 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -84.83 128.9 34.83 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.183 1.393 . . . . 0.0 111.121 175.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -146.31 158.99 43.93 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.68 133.12 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.248 1.019 . . . . 0.0 111.98 -171.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.32 174.36 10.69 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.617 2.367 . . . . 0.0 110.444 -169.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.4 140.1 17.05 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.236 1.014 . . . . 0.0 111.228 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -91.79 155.07 18.51 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.357 1.463 . . . . 0.0 110.686 173.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -15.23 51.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.3 p30 -84.98 -0.6 54.89 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.89 1.276 . . . . 0.0 113.4 171.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.4 12.99 53.29 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.658 1.123 . . . . 0.0 114.964 -177.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 m -94.7 118.63 32.04 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.41 1.605 . . . . 0.0 109.301 -170.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 t -94.59 142.47 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 123.965 0.906 . . . . 0.0 110.077 -177.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -155.02 179.56 9.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.386 1.874 . . . . 0.0 108.808 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -113.87 137.8 51.18 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.421 1.488 . . . . 0.0 109.911 169.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -126.44 127.34 45.26 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.773 1.229 . . . . 0.0 110.189 -171.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -82.99 99.72 10.0 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 122.743 0.417 . . . . 0.0 110.202 170.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.94 6.13 5.57 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 17.4 mt -93.46 -40.07 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 123.679 0.792 . . . . 0.0 109.909 169.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.9 p -105.65 -20.68 13.39 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 79.99 6.75 1.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.321 3.048 . . . . 0.0 113.83 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.27 155.15 39.58 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.524 1.057 . . . . 0.0 112.731 177.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -140.98 133.47 28.47 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.722 1.209 . . . . 0.0 112.167 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -132.6 123.05 25.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.232 1.813 . . . . 0.0 110.17 -175.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -77.55 -13.68 59.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 65.9 tt0 -58.67 142.82 48.58 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.495 0.718 . . . . 0.0 110.28 169.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -112.34 89.88 13.19 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.611 1.164 . . . . 0.0 111.084 176.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -84.64 166.03 11.97 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.02 2.48 . . . . 0.0 110.912 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.7 p -104.18 -6.43 21.0 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.64 1.576 . . . . 0.0 113.556 172.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.485 ' C ' ' H3 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.253 1.306 0 C-N-CA 127.25 2.357 . . . . 0.0 110.05 -175.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.481 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 104.424 -2.435 . . . . 0.0 104.424 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 pp -148.41 157.12 42.37 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -169.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -90.06 168.62 4.45 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.455 3.437 . . . . 0.0 114.071 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.48 140.16 44.89 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.858 3.038 . . . . 0.0 112.422 169.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 115.39 -26.22 9.26 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.749 1.166 . . . . 0.0 112.046 -171.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -90.35 145.49 24.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.468 1.107 . . . . 0.0 110.642 169.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.07 150.69 44.66 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.274 1.03 . . . . 0.0 111.389 -176.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -75.6 136.95 40.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.989 1.316 . . . . 0.0 113.345 -169.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 45.5 mmt-85 -143.2 176.09 9.39 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.637 1.175 . . . . 0.0 112.194 -178.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.49 140.03 17.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.448 1.499 . . . . 0.0 110.783 175.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.403 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 56.4 m-85 -81.74 159.3 23.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.82 1.248 . . . . 0.0 111.015 175.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.66 -14.92 49.16 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.1 p30 -87.19 -0.51 56.81 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.138 1.375 . . . . 0.0 113.266 171.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.2 14.36 51.59 Favored Glycine 0 CA--C 1.538 1.497 0 C-N-CA 124.896 1.236 . . . . 0.0 115.074 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -94.74 118.2 31.36 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.638 1.719 . . . . 0.0 109.423 -170.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.7 t -94.54 139.39 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.618 0.767 . . . . 0.0 109.788 -170.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -150.15 179.32 8.18 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.081 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -116.76 145.59 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 169.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -127.8 112.98 15.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.559 1.944 . . . . 0.0 109.995 -169.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -67.5 97.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.198 0.999 . . . . 0.0 110.672 172.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -72.31 4.35 3.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.79 -19.39 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.367 1.067 . . . . 0.0 110.354 173.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -136.44 -20.26 1.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -172.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 80.08 6.29 1.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.187 2.995 . . . . 0.0 113.491 -169.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.72 129.91 41.44 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.883 1.219 . . . . 0.0 111.55 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -117.56 127.35 53.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.731 1.212 . . . . 0.0 111.45 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -140.92 146.75 37.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.585 0.707 . . . . 0.0 111.971 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -78.13 -0.38 28.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.756 1.622 . . . . 0.0 114.5 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.08 157.57 25.35 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.703 0.801 . . . . 0.0 111.406 169.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.75 160.57 46.11 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.759 2.024 . . . . 0.0 110.17 -170.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_exo -51.47 -52.47 8.96 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.785 2.99 . . . . 0.0 113.388 174.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 t -93.26 -161.64 0.86 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.578 3.151 . . . . 0.0 110.885 171.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.347 0 C-N-CA 130.125 3.726 . . . . 0.0 116.957 175.498 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.48 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.3 tttt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -66.29 146.08 99.01 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-N 119.699 1.136 . . . . 0.0 111.017 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -80.79 172.35 13.32 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.976 2.451 . . . . 0.0 112.29 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -47.1 140.15 14.41 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 124.238 3.292 . . . . 0.0 115.313 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.98 -16.08 56.31 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.169 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -81.4 104.88 12.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.715 1.757 . . . . 0.0 110.615 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.433 ' CD ' HH22 ' A' ' 9' ' ' ARG . 2.8 pp20? -133.89 149.93 51.34 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -170.206 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.21 128.15 26.96 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.533 1.933 . . . . 0.0 115.989 -169.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.433 HH22 ' CD ' ' A' ' 7' ' ' GLU . 0.2 OUTLIER -146.18 173.25 12.39 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.949 2.5 . . . . 0.0 111.055 -171.808 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.68 140.06 17.71 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.263 1.025 . . . . 0.0 111.795 -171.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.8 m-85 -85.82 156.28 20.64 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 110.824 173.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.92 -14.49 47.41 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -86.37 -0.55 56.18 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.958 1.303 . . . . 0.0 113.38 171.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.29 14.14 52.0 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.688 1.137 . . . . 0.0 114.961 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.84 118.3 31.55 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.469 1.634 . . . . 0.0 109.231 -171.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.5 t -94.6 141.75 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.672 0.749 . . . . 0.0 110.214 -172.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -152.26 179.76 8.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.353 1.461 . . . . 0.0 110.361 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -112.77 136.49 52.33 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 125.879 1.672 . . . . 0.0 110.426 171.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -123.44 124.52 43.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.591 1.556 . . . . 0.0 109.865 -169.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -75.96 97.95 4.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.918 0.487 . . . . 0.0 111.058 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -66.7 -4.86 9.91 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -178.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.4 mt -91.98 -20.46 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.476 1.11 . . . . 0.0 110.588 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.2 p -136.23 -21.8 1.37 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -171.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 79.59 7.73 1.78 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.488 2.715 . . . . 0.0 113.52 -169.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.03 159.48 17.07 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 119.646 1.112 . . . . 0.0 111.361 171.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.1 p -149.84 150.0 31.31 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.939 -1.101 . . . . 0.0 112.672 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -150.93 128.6 11.54 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.853 1.661 . . . . 0.0 109.785 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -67.39 -33.5 75.33 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 30' ' ' ARG . 0.0 OUTLIER -63.33 152.22 38.53 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.306 1.051 . . . . 0.0 113.009 178.256 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -130.01 160.62 64.33 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 126.679 1.992 . . . . 0.0 113.643 -169.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -49.97 160.58 1.25 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 124.028 3.152 . . . . 0.0 116.455 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.9 p 167.4 78.57 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.374 3.47 . . . . 0.0 106.196 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.767 -1.574 . . . . 0.0 111.079 -169.339 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' NAG . . . . . 0.447 ' HO3' ' C7 ' ' A' ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -147.99 179.94 7.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 124.651 1.18 . . . . 0.0 110.571 178.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.77 130.58 50.57 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.322 1.449 . . . . 0.0 108.382 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -120.57 127.95 52.62 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.518 1.927 . . . . 0.0 110.705 -169.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -78.87 93.05 4.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 123.897 0.879 . . . . 0.0 110.688 172.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.265 1.4 p-80 -73.1 22.66 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mt -110.99 -19.21 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 125.346 1.458 . . . . 0.0 109.949 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.4 p -134.01 -21.61 1.87 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.057 1.343 . . . . 0.0 114.515 -174.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 80.07 8.73 1.46 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 128.765 2.826 . . . . 0.0 114.053 -169.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.3 151.77 42.89 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.953 1.251 . . . . 0.0 111.835 173.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.5 p -142.97 130.57 21.28 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.294 1.038 . . . . 0.0 112.199 -176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 124.437 1.095 . . . . 0.0 110.967 -176.236 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 122.941 1.353 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -154.4 179.75 8.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 112.514 -2.13 . . . . 0.0 107.641 -176.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -119.48 141.26 49.33 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.135 0.974 . . . . 0.0 109.197 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -127.3 128.66 46.32 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.061 1.745 . . . . 0.0 109.705 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -88.36 105.47 17.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -75.98 5.61 6.34 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -101.54 -38.54 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 124.138 0.975 . . . . 0.0 110.329 170.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -106.46 -8.96 16.87 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -176.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.99 10.74 5.56 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.928 1.691 . . . . 0.0 113.792 -170.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.2 155.74 34.05 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 120.823 -1.173 . . . . 0.0 111.884 171.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.5 p -143.3 139.16 30.0 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.323 1.049 . . . . 0.0 111.023 175.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 124.186 0.994 . . . . 0.0 111.5 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.5 t . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.245 0.545 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -148.95 179.56 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.22 1.008 . . . . 0.0 110.146 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -121.08 141.15 51.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.194 1.398 . . . . 0.0 109.845 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.22 116.96 22.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.787 1.635 . . . . 0.0 110.891 -169.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -67.36 96.23 0.48 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.329 1.052 . . . . 0.0 110.976 172.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -71.33 7.13 1.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.7 mt -96.1 -20.02 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.569 1.148 . . . . 0.0 110.444 172.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.6 p -136.09 -19.31 1.51 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -172.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 80.1 5.46 1.82 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.913 2.885 . . . . 0.0 113.634 -169.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.1 129.9 41.4 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.914 1.233 . . . . 0.0 111.962 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.7 p -117.59 122.41 43.55 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.093 1.357 . . . . 0.0 111.601 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 . . . . . 0 N--CA 1.471 0.614 0 C-N-CA 124.23 1.012 . . . . 0.0 112.667 -179.703 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.471 0.602 0 CA-C-O 121.43 0.634 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -148.99 -174.52 4.66 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.403 1.881 . . . . 0.0 109.344 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -125.57 139.6 53.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.276 1.03 . . . . 0.0 109.621 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -135.6 128.59 31.45 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.935 1.294 . . . . 0.0 111.27 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -75.26 94.4 2.99 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.693 1.997 . . . . 0.0 110.851 170.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.256 1.9 p-80 -76.7 29.97 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -116.43 -22.37 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 125.662 1.585 . . . . 0.0 109.374 169.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -137.8 -17.08 1.27 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 80.08 -1.97 2.02 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 129.322 3.049 . . . . 0.0 113.976 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.66 129.57 39.68 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.549 1.068 . . . . 0.0 109.078 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.1 139.51 22.44 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.843 -0.535 . . . . 0.0 112.053 -169.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 125.435 1.494 . . . . 0.0 110.41 -174.259 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 121.757 0.789 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -152.96 -179.28 7.53 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 126.154 1.782 . . . . 0.0 109.263 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -120.11 140.18 51.46 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.836 1.254 . . . . 0.0 109.564 170.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -123.28 117.05 24.39 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.024 0.93 . . . . 0.0 110.201 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -71.23 91.15 0.94 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.907 0.883 . . . . 0.0 109.947 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -72.3 8.18 1.45 Allowed 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.3 mt -93.7 -21.51 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.69 1.196 . . . . 0.0 110.451 170.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.8 p -138.2 -18.0 1.17 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -170.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 80.05 2.4 2.03 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.751 3.221 . . . . 0.0 113.9 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 129.9 41.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.078 1.308 . . . . 0.0 112.114 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 98.7 p -112.4 127.52 56.05 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.126 -0.984 . . . . 0.0 112.215 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 . . . . . 0 N--CA 1.467 0.402 0 C-N-CA 125.929 1.691 . . . . 0.0 110.152 -178.025 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.471 0.614 0 CA-C-O 121.758 0.79 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -152.54 179.89 8.19 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.538 1.935 . . . . 0.0 109.454 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -116.34 137.94 51.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 122.332 1.063 . . . . 0.0 111.237 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -124.34 119.26 28.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.959 1.704 . . . . 0.0 109.779 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.0 95.56 0.96 Allowed 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.231 1.012 . . . . 0.0 110.778 175.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -71.24 9.7 0.71 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -178.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.74 -20.8 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 125.141 1.377 . . . . 0.0 110.593 173.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -138.67 -5.61 1.54 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.087 1.355 . . . . 0.0 114.536 -171.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.322 0.2 OUTLIER 58.02 16.76 3.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.95 2.1 . . . . 0.0 114.706 -169.473 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.6 155.3 39.46 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 119.586 1.085 . . . . 0.0 110.704 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.6 p -147.95 128.43 14.04 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.219 -0.926 . . . . 0.0 112.505 -173.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 . . . . . 0 N--CA 1.467 0.408 0 C-N-CA 123.492 0.717 . . . . 0.0 112.638 174.958 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -151.95 179.44 8.46 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.636 1.174 . . . . 0.0 110.475 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -116.17 139.35 50.42 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.182 1.393 . . . . 0.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -123.23 114.84 20.79 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.681 1.992 . . . . 0.0 109.585 -169.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -68.84 101.01 1.26 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.827 0.851 . . . . 0.0 110.972 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -71.22 0.48 7.79 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.1 mt -94.04 -20.2 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.358 1.063 . . . . 0.0 110.565 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -135.19 -20.44 1.66 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 79.98 3.7 2.0 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 128.923 2.889 . . . . 0.0 113.514 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.24 136.76 57.91 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.796 1.18 . . . . 0.0 111.469 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.3 p -125.96 122.8 37.0 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.193 0.997 . . . . 0.0 111.636 -174.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 124.0 0.92 . . . . 0.0 112.166 -178.474 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.0 t . . . . . 0 N--CA 1.472 0.668 0 CA-C-O 121.653 0.74 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -153.65 -172.85 4.36 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.203 1.801 . . . . 0.0 110.16 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.53 137.89 54.38 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.968 1.307 . . . . 0.0 110.195 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -125.95 126.2 43.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.3 1.44 . . . . 0.0 110.224 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -80.97 94.89 6.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.664 0.785 . . . . 0.0 110.244 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -71.87 6.15 2.2 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.9 mm -95.58 -21.7 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.448 1.099 . . . . 0.0 111.304 170.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.9 p -136.75 -11.66 1.78 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -169.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 69.69 11.11 7.82 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.909 1.683 . . . . 0.0 113.546 -169.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 157.73 31.36 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 120.092 1.315 . . . . 0.0 111.899 169.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -147.93 134.81 20.12 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.274 -0.891 . . . . 0.0 112.106 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 . . . . . 0 N--CA 1.468 0.467 0 C-N-CA 125.211 1.404 . . . . 0.0 110.642 177.771 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.471 0.583 0 CA-C-O 121.847 0.832 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -141.96 179.67 6.74 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.423 1.889 . . . . 0.0 109.795 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -118.14 134.76 54.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.943 0.878 . . . . 0.0 110.136 176.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -121.94 130.61 53.47 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.127 1.771 . . . . 0.0 110.705 -169.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -82.72 101.44 10.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.436 0.694 . . . . 0.0 111.013 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -68.53 -4.91 16.82 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.2 mt -92.6 -19.91 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.443 1.097 . . . . 0.0 110.694 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.7 p -136.7 -11.06 1.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -170.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 66.55 12.53 8.8 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.177 1.391 . . . . 0.0 113.136 -170.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.88 33.27 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.467 -1.395 . . . . 0.0 111.454 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.4 p -151.14 129.78 12.28 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.162 -0.961 . . . . 0.0 111.918 -175.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 . . . . . 0 N--CA 1.468 0.45 0 C-N-CA 124.664 1.185 . . . . 0.0 112.302 -177.611 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -150.65 179.59 8.06 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.211 1.804 . . . . 0.0 109.772 -177.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -111.16 135.07 52.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.687 1.195 . . . . 0.0 112.148 169.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -130.95 136.42 48.54 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.554 1.142 . . . . 0.0 111.938 -174.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -88.84 98.86 11.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.662 0.785 . . . . 0.0 110.618 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -76.04 25.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.4 mt -122.45 -40.01 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.127 1.371 . . . . 0.0 109.803 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -101.23 -22.11 14.73 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 79.58 8.01 1.75 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.05 2.94 . . . . 0.0 114.013 -170.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.16 153.28 30.67 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.256 0.935 . . . . 0.0 112.09 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -142.74 150.19 39.75 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.273 1.029 . . . . 0.0 112.232 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.356 0 C-N-CA 124.601 1.161 . . . . 0.0 110.931 174.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 t . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.52 0.676 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.04 179.63 7.6 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.988 1.315 . . . . 0.0 109.386 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -118.05 143.03 46.77 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.746 1.218 . . . . 0.0 110.853 170.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -129.89 122.11 27.99 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.801 1.64 . . . . 0.0 109.241 -170.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -72.28 91.39 1.31 Allowed 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 110.379 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.264 1.5 p-80 -73.88 26.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 177.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.9 mt -114.13 -20.12 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 126.011 1.724 . . . . 0.0 109.633 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.1 p -134.73 -21.28 1.72 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.227 1.411 . . . . 0.0 114.623 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 80.08 8.54 1.48 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.538 2.735 . . . . 0.0 114.018 -169.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.74 152.88 43.28 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.115 1.325 . . . . 0.0 111.461 172.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.9 p -147.06 138.23 23.95 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.213 -0.929 . . . . 0.0 112.64 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 123.562 0.745 . . . . 0.0 111.296 175.69 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 122.066 0.936 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -154.41 179.97 8.5 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.991 1.717 . . . . 0.0 109.256 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -117.85 140.46 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.542 1.137 . . . . 0.0 109.892 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -125.89 120.37 30.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.043 1.337 . . . . 0.0 110.599 -169.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -73.28 97.33 2.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.806 0.842 . . . . 0.0 110.71 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -71.43 3.28 3.93 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.9 mp -96.89 -23.64 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 110.758 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -130.52 -20.68 2.91 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 78.28 6.72 2.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.227 2.611 . . . . 0.0 113.53 -169.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.95 156.5 27.65 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.651 1.114 . . . . 0.0 111.383 172.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -144.14 150.03 37.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.382 -0.824 . . . . 0.0 112.734 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 . . . . . 0 CA--C 1.539 0.525 0 C-N-CA 125.193 1.397 . . . . 0.0 109.666 -176.723 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 121.481 0.658 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -149.69 -177.35 5.83 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.238 1.415 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.11 130.67 53.45 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.738 1.215 . . . . 0.0 108.98 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -124.91 140.03 53.3 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.245 1.418 . . . . 0.0 111.336 -169.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.54 104.41 16.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.358 0.663 . . . . 0.0 111.539 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -2.26 14.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.7 mm -91.55 -23.96 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.903 0.881 . . . . 0.0 111.447 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.1 p -133.6 -11.17 2.75 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -169.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 66.38 13.27 9.15 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.914 1.286 . . . . 0.0 113.101 -169.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.39 156.65 31.58 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.71 -1.244 . . . . 0.0 111.291 169.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.0 p -150.84 139.92 21.09 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.489 -0.757 . . . . 0.0 112.082 -178.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 125.111 1.364 . . . . 0.0 110.642 174.517 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 121.372 0.606 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -149.1 179.86 7.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.171 1.388 . . . . 0.0 110.742 178.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -114.88 133.19 56.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.548 1.539 . . . . 0.0 110.703 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -123.02 116.21 23.15 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.042 1.737 . . . . 0.0 109.031 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -74.39 97.32 3.03 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.511 0.724 . . . . 0.0 110.086 174.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -69.58 3.35 2.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.3 mt -95.43 -20.1 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 119.25 0.932 . . . . 0.0 110.978 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -134.11 -20.04 1.94 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -171.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 79.04 5.92 2.22 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 129.161 2.984 . . . . 0.0 113.154 -169.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.32 129.86 41.59 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.86 1.209 . . . . 0.0 111.253 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.5 p -120.41 123.3 42.71 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.144 0.977 . . . . 0.0 111.769 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 . . . . . 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 110.235 179.054 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.8 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 121.631 0.729 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -143.85 179.61 7.06 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.101 1.36 . . . . 0.0 109.822 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -122.76 143.52 49.77 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.096 1.359 . . . . 0.0 109.234 172.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -124.28 119.52 29.54 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.724 1.61 . . . . 0.0 110.633 -169.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -64.52 101.55 0.46 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.366 0.667 . . . . 0.0 109.992 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -75.41 3.64 8.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -97.46 -32.74 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.473 1.509 . . . . 0.0 110.214 174.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 32.0 p -119.09 -18.12 8.8 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 80.01 1.38 2.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 129.245 3.018 . . . . 0.0 114.38 -170.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.77 129.67 40.61 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.975 1.261 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.6 p -112.68 124.43 52.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.998 1.319 . . . . 0.0 111.541 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.868 0.842 . . . . 0.0 111.95 -179.047 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 121.898 0.856 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -151.12 179.9 7.88 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.381 1.472 . . . . 0.0 109.904 -177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -119.69 143.46 47.74 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.85 0.86 . . . . 0.0 109.594 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -131.52 140.06 49.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.631 1.572 . . . . 0.0 109.529 -173.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -98.38 94.96 7.03 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.681 0.792 . . . . 0.0 110.083 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.283 1.6 p-80 -74.82 20.18 0.13 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.4 mt -112.19 -17.66 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 C-N-CA 125.516 1.527 . . . . 0.0 110.183 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.8 p -135.18 -11.5 2.2 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -175.209 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.3 11.67 8.51 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.067 1.747 . . . . 0.0 113.659 -169.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.62 155.84 31.99 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.129 1.332 . . . . 0.0 111.869 170.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.8 p -150.55 140.48 21.93 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.05 0.94 . . . . 0.0 111.944 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 123.837 0.855 . . . . 0.0 112.799 176.952 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -149.55 179.5 7.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.713 0.768 . . . . 0.0 111.023 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -126.05 110.94 14.12 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 126.131 1.772 . . . . 0.0 110.891 -173.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -109.99 126.04 53.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 126.092 1.757 . . . . 0.0 111.816 -169.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -77.3 103.35 7.18 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.923 0.889 . . . . 0.0 109.148 169.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -75.93 15.22 0.56 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.2 mt -112.11 -39.99 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.003 1.321 . . . . 0.0 110.329 169.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.7 p -105.31 -20.0 13.63 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -177.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 79.46 2.79 2.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.821 2.848 . . . . 0.0 114.323 -171.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 129.96 44.3 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.605 1.093 . . . . 0.0 111.923 176.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -123.75 119.27 29.26 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.055 1.342 . . . . 0.0 111.438 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 N--CA 1.465 0.317 0 C-N-CA 124.068 0.947 . . . . 0.0 111.004 -176.142 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.469 0.507 0 CA-C-O 121.822 0.82 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -155.02 179.56 9.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.386 1.874 . . . . 0.0 108.808 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -113.87 137.8 51.18 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.421 1.488 . . . . 0.0 109.911 169.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -126.44 127.34 45.26 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.773 1.229 . . . . 0.0 110.189 -171.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -82.99 99.72 10.0 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 122.743 0.417 . . . . 0.0 110.202 170.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.94 6.13 5.57 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 17.4 mt -93.46 -40.07 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 123.679 0.792 . . . . 0.0 109.909 169.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.9 p -105.65 -20.68 13.39 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 79.99 6.75 1.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.321 3.048 . . . . 0.0 113.83 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.27 155.15 39.58 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.524 1.057 . . . . 0.0 112.731 177.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -140.98 133.47 28.47 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.722 1.209 . . . . 0.0 112.167 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 126.232 1.813 . . . . 0.0 110.17 -175.308 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.471 0.604 0 CA-C-O 121.491 0.662 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -150.15 179.32 8.18 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.081 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -116.76 145.59 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 169.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -127.8 112.98 15.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.559 1.944 . . . . 0.0 109.995 -169.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -67.5 97.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.198 0.999 . . . . 0.0 110.672 172.58 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -72.31 4.35 3.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.79 -19.39 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.367 1.067 . . . . 0.0 110.354 173.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -136.44 -20.26 1.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -172.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 80.08 6.29 1.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.187 2.995 . . . . 0.0 113.491 -169.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.72 129.91 41.44 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.883 1.219 . . . . 0.0 111.55 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -117.56 127.35 53.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.731 1.212 . . . . 0.0 111.45 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 121.585 0.707 . . . . 0.0 111.971 178.624 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.5 t . . . . . 0 N--CA 1.469 0.519 0 CA-C-O 121.672 0.749 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -152.26 179.76 8.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.353 1.461 . . . . 0.0 110.361 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -112.77 136.49 52.33 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 125.879 1.672 . . . . 0.0 110.426 171.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -123.44 124.52 43.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.591 1.556 . . . . 0.0 109.865 -169.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -75.96 97.95 4.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.918 0.487 . . . . 0.0 111.058 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -66.7 -4.86 9.91 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -178.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.4 mt -91.98 -20.46 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.476 1.11 . . . . 0.0 110.588 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.2 p -136.23 -21.8 1.37 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -171.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 79.59 7.73 1.78 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.488 2.715 . . . . 0.0 113.52 -169.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.03 159.48 17.07 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 119.646 1.112 . . . . 0.0 111.361 171.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.1 p -149.84 150.0 31.31 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.939 -1.101 . . . . 0.0 112.672 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 125.853 1.661 . . . . 0.0 109.785 -172.614 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.533 ' H3 ' ' CD ' ' A' ' 29' ' ' GLU . 36.2 mtmm . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 117.651 -1.166 . . . . 0.0 109.881 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 33.3 mt 73.68 119.65 0.03 OUTLIER Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 129.254 3.022 . . . . 0.0 116.542 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -72.03 174.92 10.55 Favored 'Trans proline' 0 CA--C 1.552 1.395 0 C-N-CA 123.118 2.545 . . . . 0.0 111.253 169.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.63 130.13 25.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.785 2.99 . . . . 0.0 114.212 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.21 -7.16 81.71 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.645 1.117 . . . . 0.0 115.854 173.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.13 131.85 34.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.742 1.271 . . . . 0.0 111.316 176.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -148.17 157.05 43.28 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.827 0.851 . . . . 0.0 110.94 -176.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -67.6 140.94 56.92 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.753 2.021 . . . . 0.0 114.155 -169.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -143.55 -179.83 6.67 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.656 2.382 . . . . 0.0 110.641 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.5 140.28 18.1 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.282 1.033 . . . . 0.0 111.238 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -81.87 130.78 35.18 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.882 2.073 . . . . 0.0 109.3 171.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.1 -26.88 66.57 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -72.4 3.83 4.39 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.583 1.553 . . . . 0.0 113.691 169.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.83 61.82 0.99 Allowed Glycine 0 C--N 1.341 0.858 0 C-N-CA 125.521 1.534 . . . . 0.0 114.859 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.1 m -153.16 133.17 13.31 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.668 1.734 . . . . 0.0 111.294 170.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.6 t -94.71 141.29 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.259 1.024 . . . . 0.0 109.646 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -147.99 179.94 7.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 124.651 1.18 . . . . 0.0 110.571 178.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.77 130.58 50.57 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.322 1.449 . . . . 0.0 108.382 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -120.57 127.95 52.62 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.518 1.927 . . . . 0.0 110.705 -169.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -78.87 93.05 4.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 123.897 0.879 . . . . 0.0 110.688 172.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.265 1.4 p-80 -73.1 22.66 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mt -110.99 -19.21 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 125.346 1.458 . . . . 0.0 109.949 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.4 p -134.01 -21.61 1.87 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.057 1.343 . . . . 0.0 114.515 -174.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 80.07 8.73 1.46 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 128.765 2.826 . . . . 0.0 114.053 -169.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.3 151.77 42.89 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.953 1.251 . . . . 0.0 111.835 173.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.5 p -142.97 130.57 21.28 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.294 1.038 . . . . 0.0 112.199 -176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -148.65 154.28 39.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.437 1.095 . . . . 0.0 110.967 -176.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -85.23 4.95 32.31 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.533 ' CD ' ' H3 ' ' A' ' 1' ' ' LYS . 3.3 tm-20 -64.67 109.7 2.1 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.619 1.568 . . . . 0.0 110.219 -177.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -98.43 134.85 21.48 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -169.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -83.39 -155.02 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.214 1 C-N-CA 125.401 4.067 . . . . 0.0 110.202 169.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.5 p -61.22 -23.38 65.58 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 120.387 -1.446 . . . . 0.0 114.172 170.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.028 0 C-N-CA 127.036 2.255 . . . . 0.0 114.034 -176.088 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.1 tptp . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 118.371 -0.823 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.19 158.92 82.81 Favored Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 118.742 -0.647 . . . . 0.0 109.863 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.67 170.83 11.81 Favored 'Trans proline' 0 CA--C 1.55 1.29 0 C-N-CA 123.461 2.774 . . . . 0.0 113.832 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -43.52 108.92 0.12 Allowed 'Trans proline' 0 C--N 1.354 0.834 1 C-N-CA 125.315 4.01 . . . . 0.0 115.703 -178.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.23 0.64 89.92 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.002 -1.444 . . . . 0.0 115.379 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -86.34 144.49 27.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.872 1.836 . . . . 0.0 112.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.62 153.9 46.24 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.023 2.129 . . . . 0.0 110.176 -175.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt -100.03 128.98 46.04 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.18 0.9 . . . . 0.0 111.602 -175.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.75 178.02 7.08 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 121.154 -0.966 . . . . 0.0 110.97 -169.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . 0.413 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 60.2 ttm -154.32 121.06 5.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.678 1.991 . . . . 0.0 106.884 -173.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -67.71 161.74 25.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.766 1.226 . . . . 0.0 111.468 174.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.1 -11.6 14.98 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -93.34 0.39 56.9 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.538 1.535 . . . . 0.0 113.246 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.14 11.68 58.36 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.25 1.405 . . . . 0.0 115.281 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.1 m -95.01 118.83 32.49 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.723 1.761 . . . . 0.0 108.822 -169.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.413 ' HA ' ' HA ' ' A' ' 10' ' ' MET . 35.8 m -94.39 155.6 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 122.941 1.353 . . . . 0.0 111.582 -176.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -154.4 179.75 8.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 112.514 -2.13 . . . . 0.0 107.641 -176.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -119.48 141.26 49.33 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.135 0.974 . . . . 0.0 109.197 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -127.3 128.66 46.32 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.061 1.745 . . . . 0.0 109.705 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -88.36 105.47 17.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -75.98 5.61 6.34 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -101.54 -38.54 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 124.138 0.975 . . . . 0.0 110.329 170.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -106.46 -8.96 16.87 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -176.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.99 10.74 5.56 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.928 1.691 . . . . 0.0 113.792 -170.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.2 155.74 34.05 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 120.823 -1.173 . . . . 0.0 111.884 171.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.5 p -143.3 139.16 30.0 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.323 1.049 . . . . 0.0 111.023 175.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -143.05 146.4 33.79 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.186 0.994 . . . . 0.0 111.5 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -84.4 -22.26 30.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.213 1.005 . . . . 0.0 111.711 169.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -62.41 109.61 1.41 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.362 0.528 . . . . 0.0 110.353 171.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.88 111.67 12.31 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.537 1.135 . . . . 0.0 113.467 -175.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -86.67 84.11 1.06 Allowed 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.739 2.293 . . . . 0.0 110.864 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 p 76.79 -8.4 1.68 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 129.646 3.178 . . . . 0.0 115.657 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.308 0 CA-C-O 116.814 -2.103 . . . . 0.0 115.219 177.551 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 27.4 tp -146.74 119.61 4.95 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 119.596 1.089 . . . . 0.0 110.628 172.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -80.31 166.41 20.34 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 122.861 2.374 . . . . 0.0 113.114 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.8 134.21 47.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.0 3.133 . . . . 0.0 113.889 172.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.42 -2.3 85.46 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-O 118.606 -1.108 . . . . 0.0 115.574 175.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -90.1 131.18 36.1 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.073 1.437 . . . . 0.0 111.013 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.47 147.09 48.77 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.017 0.927 . . . . 0.0 112.676 -171.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 pttm -66.92 123.7 20.91 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.71 2.004 . . . . 0.0 115.065 -169.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -130.33 177.73 7.12 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.495 1.918 . . . . 0.0 110.86 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.4 ttm -154.48 127.74 8.43 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.301 1.04 . . . . 0.0 110.632 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 71.9 m-85 -71.42 131.42 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.712 1.605 . . . . 0.0 109.503 169.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.99 -28.01 67.33 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -174.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -73.2 5.64 3.38 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.012 1.725 . . . . 0.0 113.689 170.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.54 63.82 1.07 Allowed Glycine 0 C--N 1.341 0.812 0 C-N-CA 125.608 1.575 . . . . 0.0 114.776 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 55.4 m -152.88 131.05 11.93 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.557 1.678 . . . . 0.0 111.199 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.5 t -94.69 142.4 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.846 0.858 . . . . 0.0 109.594 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -148.95 179.56 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.22 1.008 . . . . 0.0 110.146 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -121.08 141.15 51.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.194 1.398 . . . . 0.0 109.845 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.22 116.96 22.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.787 1.635 . . . . 0.0 110.891 -169.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -67.36 96.23 0.48 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.329 1.052 . . . . 0.0 110.976 172.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -71.33 7.13 1.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.7 mt -96.1 -20.02 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.569 1.148 . . . . 0.0 110.444 172.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.6 p -136.09 -19.31 1.51 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -172.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 80.1 5.46 1.82 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.913 2.885 . . . . 0.0 113.634 -169.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.1 129.9 41.4 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.914 1.233 . . . . 0.0 111.962 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.7 p -117.59 122.41 43.55 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.093 1.357 . . . . 0.0 111.601 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -139.54 153.93 47.55 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.23 1.012 . . . . 0.0 112.667 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -83.1 5.07 23.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.251 1.42 . . . . 0.0 114.222 -177.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.7 109.84 4.01 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.655 -0.653 . . . . 0.0 111.128 170.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' CZ ' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -97.08 154.39 38.18 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 126.389 1.876 . . . . 0.0 109.424 175.01 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -49.88 -35.07 38.98 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 124.206 3.271 . . . . 0.0 115.156 173.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.7 m -67.57 94.48 0.42 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 128.855 2.862 . . . . 0.0 111.733 173.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.175 0 CA-C-O 118.619 -1.101 . . . . 0.0 114.489 171.679 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.402 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 18.7 mt -87.82 119.91 70.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.077 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -67.22 170.18 13.8 Favored 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 122.728 2.285 . . . . 0.0 112.339 169.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -49.69 131.78 29.54 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.828 3.019 . . . . 0.0 114.157 173.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.77 -5.88 80.37 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 124.501 1.048 . . . . 0.0 115.575 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -83.05 136.49 34.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.655 1.228 . . . . 0.0 111.68 174.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.3 163.15 40.03 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.208 0.603 . . . . 0.0 111.456 169.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -49.97 142.81 8.68 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.639 2.376 . . . . 0.0 113.448 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.22 171.71 16.5 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.518 2.327 . . . . 0.0 109.92 -174.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.63 140.03 17.73 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.531 0.681 . . . . 0.0 112.381 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.404 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 72.8 m-85 -84.09 147.2 27.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.218 1.407 . . . . 0.0 110.082 173.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -18.31 46.08 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -68.44 -12.87 61.8 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.634 1.174 . . . . 0.0 113.778 170.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.81 68.98 1.41 Allowed Glycine 0 CA--C 1.53 1.003 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 -169.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.4 m -151.74 122.57 7.52 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.677 -1.484 . . . . 0.0 109.166 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -94.77 141.6 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.723 0.809 . . . . 0.0 110.248 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -148.99 -174.52 4.66 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.403 1.881 . . . . 0.0 109.344 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -125.57 139.6 53.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.276 1.03 . . . . 0.0 109.621 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -135.6 128.59 31.45 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.935 1.294 . . . . 0.0 111.27 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -75.26 94.4 2.99 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.693 1.997 . . . . 0.0 110.851 170.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.256 1.9 p-80 -76.7 29.97 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -116.43 -22.37 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 125.662 1.585 . . . . 0.0 109.374 169.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -137.8 -17.08 1.27 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 80.08 -1.97 2.02 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 129.322 3.049 . . . . 0.0 113.976 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.66 129.57 39.68 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.549 1.068 . . . . 0.0 109.078 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.1 139.51 22.44 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.843 -0.535 . . . . 0.0 112.053 -169.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -163.88 167.93 20.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.435 1.494 . . . . 0.0 110.41 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -78.85 4.99 12.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.895 1.278 . . . . 0.0 113.287 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -51.64 109.58 0.37 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.351 1.86 . . . . 0.0 110.514 172.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.9 ttt-85 -98.79 152.1 37.69 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.516 1.526 . . . . 0.0 110.38 -171.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_exo -49.63 -73.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 123.822 3.015 . . . . 0.0 116.241 -170.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.6 m -179.06 174.01 1.11 Allowed 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 130.366 3.466 . . . . 0.0 109.847 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.107 -1.385 . . . . 0.0 112.013 -174.708 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.404 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.9 pttm . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 pp -161.65 157.53 21.17 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-O 118.574 -0.727 . . . . 0.0 112.242 -169.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -86.63 168.0 8.51 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.024 3.149 . . . . 0.0 113.211 177.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.37 140.19 15.78 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.628 3.552 . . . . 0.0 114.103 169.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.24 -37.4 3.63 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.183 1.373 . . . . 0.0 111.471 -174.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -78.45 114.5 17.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.048 1.339 . . . . 0.0 110.335 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -119.88 139.5 52.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.937 0.895 . . . . 0.0 111.49 -171.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -56.99 123.11 14.0 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.771 1.629 . . . . 0.0 111.719 -173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.38 167.47 21.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.096 2.158 . . . . 0.0 111.389 -169.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -154.63 130.15 9.86 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.079 0.552 . . . . 0.0 111.17 -169.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -87.89 133.49 33.9 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.913 1.685 . . . . 0.0 109.783 173.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.91 -19.51 12.35 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 173.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.88 -9.79 10.99 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 127.827 2.451 . . . . 0.0 112.714 169.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.45 59.94 1.96 Allowed Glycine 0 C--N 1.34 0.805 0 C-N-CA 125.129 1.347 . . . . 0.0 110.951 -176.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 92.1 m -152.44 122.16 6.93 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.673 -1.487 . . . . 0.0 110.451 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.0 t -94.86 143.57 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.986 0.914 . . . . 0.0 110.139 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -152.96 -179.28 7.53 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 126.154 1.782 . . . . 0.0 109.263 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -120.11 140.18 51.46 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.836 1.254 . . . . 0.0 109.564 170.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -123.28 117.05 24.39 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.024 0.93 . . . . 0.0 110.201 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -71.23 91.15 0.94 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.907 0.883 . . . . 0.0 109.947 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -72.3 8.18 1.45 Allowed 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.3 mt -93.7 -21.51 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.69 1.196 . . . . 0.0 110.451 170.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.8 p -138.2 -18.0 1.17 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -170.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 80.05 2.4 2.03 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.751 3.221 . . . . 0.0 113.9 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 129.9 41.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.078 1.308 . . . . 0.0 112.114 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 98.7 p -112.4 127.52 56.05 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.126 -0.984 . . . . 0.0 112.215 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -122.56 124.63 43.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.929 1.691 . . . . 0.0 110.152 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -80.62 -30.79 36.72 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.69 109.13 10.2 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 122.012 0.911 . . . . 0.0 108.967 -175.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 154.17 80.85 Favored Pre-proline 0 N--CA 1.473 0.697 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -169.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -84.11 -175.13 2.09 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.477 3.451 . . . . 0.0 110.344 169.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.4 p -75.34 65.49 1.65 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.347 -0.845 . . . . 0.0 109.766 169.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.263 0 C-N-CA 125.0 1.286 . . . . 0.0 112.785 -172.973 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 119.407 -0.33 . . . . 0.0 111.834 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.445 HD21 ' CD2' ' A' ' 18' ' ' TYR . 3.1 pp -153.65 152.66 27.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.011 0.924 . . . . 0.0 110.525 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -83.79 165.45 13.65 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.217 2.611 . . . . 0.0 112.048 175.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -60.25 140.21 90.9 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.177 2.585 . . . . 0.0 112.493 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 106.17 -21.26 33.8 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.146 1.355 . . . . 0.0 113.654 -177.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.14 107.23 17.11 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.61 1.164 . . . . 0.0 109.999 171.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -119.92 149.65 41.76 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.038 0.935 . . . . 0.0 111.432 -169.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 118.41 5.04 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 128.465 2.706 . . . . 0.0 112.692 -171.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -133.48 168.2 19.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.924 2.089 . . . . 0.0 110.633 -172.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 24.8 ttt -154.72 131.97 11.08 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.885 -0.509 . . . . 0.0 111.379 -169.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 57.9 m-85 -83.71 156.02 22.81 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.354 1.462 . . . . 0.0 111.08 178.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.82 -16.08 56.83 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -83.94 -1.85 55.4 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.435 1.094 . . . . 0.0 113.435 170.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.98 11.38 53.23 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.867 1.222 . . . . 0.0 115.234 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.0 m -94.82 122.68 37.7 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.558 1.679 . . . . 0.0 109.931 -169.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -94.65 142.59 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-O 121.758 0.79 . . . . 0.0 110.49 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -152.54 179.89 8.19 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.538 1.935 . . . . 0.0 109.454 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.445 ' CD2' HD21 ' A' ' 2' ' ' LEU . 28.7 m-85 -116.34 137.94 51.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 122.332 1.063 . . . . 0.0 111.237 171.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -124.34 119.26 28.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.959 1.704 . . . . 0.0 109.779 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.0 95.56 0.96 Allowed 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.231 1.012 . . . . 0.0 110.778 175.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -71.24 9.7 0.71 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -178.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.74 -20.8 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 125.141 1.377 . . . . 0.0 110.593 173.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -138.67 -5.61 1.54 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.087 1.355 . . . . 0.0 114.536 -171.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.322 0.2 OUTLIER 58.02 16.76 3.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.95 2.1 . . . . 0.0 114.706 -169.473 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.6 155.3 39.46 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 119.586 1.085 . . . . 0.0 110.704 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.6 p -147.95 128.43 14.04 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.219 -0.926 . . . . 0.0 112.505 -173.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -146.02 161.98 38.91 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.492 0.717 . . . . 0.0 112.638 174.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -85.51 -10.16 56.41 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.97 149.78 49.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.165 0.893 . . . . 0.0 111.575 171.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' H ' ' HD3' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -130.41 162.33 55.15 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 127.641 2.376 . . . . 0.0 112.987 -169.529 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -49.84 171.39 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.696 2.931 . . . . 0.0 113.799 172.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 54.1 p 68.17 -171.93 0.19 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.394 1.478 . . . . 0.0 110.555 -169.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.271 0 C-N-CA 124.878 1.228 . . . . 0.0 114.301 -174.55 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.407 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.1 tttp . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 116.366 -1.778 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.3 tp -53.37 119.65 18.34 Favored Pre-proline 0 CA--C 1.55 0.944 0 CA-C-N 120.305 1.411 . . . . 0.0 111.355 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.53 157.44 58.87 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 122.085 1.856 . . . . 0.0 112.971 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.55 132.55 25.64 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.38 2.72 . . . . 0.0 112.725 -172.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.13 1.45 90.35 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 118.835 -0.981 . . . . 0.0 114.768 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -90.04 131.74 35.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.839 1.32 . . . . 0.0 110.517 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.17 141.13 51.56 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.089 1.756 . . . . 0.0 109.908 -169.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.37 143.81 48.45 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.863 -1.148 . . . . 0.0 112.928 -171.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.9 tpp85 -150.14 172.33 15.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.817 1.247 . . . . 0.0 111.561 -171.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.6 ttp -154.84 133.63 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.867 0.867 . . . . 0.0 110.154 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.44 159.82 33.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.004 0.522 . . . . 0.0 111.55 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.14 -17.87 59.18 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -84.78 -0.31 53.35 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.903 1.281 . . . . 0.0 113.611 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.14 11.64 51.83 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 125.076 1.322 . . . . 0.0 115.099 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 m -94.85 99.45 11.5 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.061 1.931 . . . . 0.0 110.553 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.4 t -46.01 136.61 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.94 1.696 . . . . 0.0 114.266 169.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -151.95 179.44 8.46 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.636 1.174 . . . . 0.0 110.475 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -116.17 139.35 50.42 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.182 1.393 . . . . 0.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -123.23 114.84 20.79 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.681 1.992 . . . . 0.0 109.585 -169.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -68.84 101.01 1.26 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.827 0.851 . . . . 0.0 110.972 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -71.22 0.48 7.79 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.1 mt -94.04 -20.2 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.358 1.063 . . . . 0.0 110.565 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -135.19 -20.44 1.66 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 79.98 3.7 2.0 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 128.923 2.889 . . . . 0.0 113.514 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.24 136.76 57.91 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.796 1.18 . . . . 0.0 111.469 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.3 p -125.96 122.8 37.0 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.193 0.997 . . . . 0.0 111.636 -174.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -134.96 148.37 49.99 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.0 0.92 . . . . 0.0 112.166 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -75.93 5.18 6.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.693 1.197 . . . . 0.0 113.998 174.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -54.84 109.92 0.58 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.87 1.268 . . . . 0.0 109.248 169.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.1 ttp-105 -110.56 112.11 56.76 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.237 1.015 . . . . 0.0 109.665 -175.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.34 178.94 5.51 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.815 3.01 . . . . 0.0 112.963 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.3 m -155.55 32.76 0.37 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.078 1.751 . . . . 0.0 109.453 169.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.423 0 C-N-CA 127.753 2.597 . . . . 0.0 110.125 -169.745 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.404 ' HB3' ' HE3' ' A' ' 1' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.463 HD21 ' CD2' ' A' ' 18' ' ' TYR . 2.8 pp -158.48 139.65 9.55 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.652 1.581 . . . . 0.0 110.098 169.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -81.37 172.36 12.71 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.911 3.074 . . . . 0.0 112.781 175.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -59.66 140.23 92.62 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.025 2.483 . . . . 0.0 111.337 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 -21.4 21.29 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.183 1.373 . . . . 0.0 112.505 -170.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -90.32 150.44 21.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.302 1.441 . . . . 0.0 111.031 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -145.12 152.27 39.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.272 1.029 . . . . 0.0 111.215 171.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 pttm -61.4 136.23 57.96 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.24 1.816 . . . . 0.0 111.62 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -145.51 173.96 11.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.146 1.378 . . . . 0.0 110.707 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttm -154.39 140.02 17.95 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.384 1.474 . . . . 0.0 108.849 -177.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 50.3 m-85 -83.06 161.95 21.52 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.133 1.773 . . . . 0.0 111.449 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.87 -7.5 5.23 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 p30 -99.4 0.93 43.73 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.693 1.597 . . . . 0.0 113.145 172.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.01 12.34 56.6 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.553 1.073 . . . . 0.0 115.303 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.7 m -94.8 124.27 38.74 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.645 1.722 . . . . 0.0 109.477 -170.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.0 t -94.67 139.6 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.748 0.819 . . . . 0.0 110.954 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -153.65 -172.85 4.36 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.203 1.801 . . . . 0.0 110.16 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.463 ' CD2' HD21 ' A' ' 2' ' ' LEU . 54.7 m-85 -124.53 137.89 54.38 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.968 1.307 . . . . 0.0 110.195 173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -125.95 126.2 43.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.3 1.44 . . . . 0.0 110.224 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -80.97 94.89 6.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.664 0.785 . . . . 0.0 110.244 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -71.87 6.15 2.2 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.9 mm -95.58 -21.7 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.448 1.099 . . . . 0.0 111.304 170.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.9 p -136.75 -11.66 1.78 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -169.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 69.69 11.11 7.82 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.909 1.683 . . . . 0.0 113.546 -169.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 157.73 31.36 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 120.092 1.315 . . . . 0.0 111.899 169.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -147.93 134.81 20.12 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.274 -0.891 . . . . 0.0 112.106 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -135.23 148.86 49.74 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.211 1.404 . . . . 0.0 110.642 177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -82.35 -14.18 55.7 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 170.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -66.27 140.53 58.14 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.199 0.999 . . . . 0.0 112.08 177.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.02 160.53 32.0 Favored Pre-proline 0 CA--C 1.542 0.645 0 C-N-CA 128.467 2.707 . . . . 0.0 114.504 -169.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.22 174.13 0.19 Allowed 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.517 3.478 . . . . 0.0 115.692 170.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.9 m 66.04 74.37 0.36 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 127.652 2.381 . . . . 0.0 113.488 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 C-N-CA 124.242 0.925 . . . . 0.0 111.363 -173.156 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.407 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 mtmm . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' A' ' 18' ' ' TYR . 90.2 mt -141.85 119.66 7.57 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 119.475 1.034 . . . . 0.0 111.359 169.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -73.63 176.06 9.85 Favored 'Trans proline' 0 CA--C 1.551 1.372 0 C-N-CA 122.993 2.462 . . . . 0.0 111.277 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -48.71 120.54 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.159 3.239 . . . . 0.0 114.538 173.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.51 1.0 83.91 Favored Glycine 0 CA--C 1.533 1.214 0 N-CA-C 115.951 1.141 . . . . 0.0 115.951 172.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -86.44 123.38 31.6 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.348 1.574 . . . . 0.0 111.532 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -144.79 160.83 40.62 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.77 132.29 51.76 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -169.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.39 168.95 19.27 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.986 1.714 . . . . 0.0 109.956 -176.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.8 ttp -154.72 140.05 17.67 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.388 -0.82 . . . . 0.0 111.598 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -83.32 161.49 21.41 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.331 1.053 . . . . 0.0 111.458 172.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.23 -25.77 48.77 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -68.8 19.4 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.531 1.933 . . . . 0.0 113.849 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 48.07 30.53 7.5 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.303 1.43 . . . . 0.0 113.463 -170.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.3 m -101.84 112.25 24.8 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 123.634 0.773 . . . . 0.0 108.951 -169.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.6 t -94.5 132.32 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.837 0.855 . . . . 0.0 110.272 -169.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -141.96 179.67 6.74 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.423 1.889 . . . . 0.0 109.795 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.448 ' CD2' HD21 ' A' ' 2' ' ' LEU . 40.1 m-85 -118.14 134.76 54.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.943 0.878 . . . . 0.0 110.136 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -121.94 130.61 53.47 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.127 1.771 . . . . 0.0 110.705 -169.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -82.72 101.44 10.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.436 0.694 . . . . 0.0 111.013 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -68.53 -4.91 16.82 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.2 mt -92.6 -19.91 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.443 1.097 . . . . 0.0 110.694 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.7 p -136.7 -11.06 1.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -170.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 66.55 12.53 8.8 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.177 1.391 . . . . 0.0 113.136 -170.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.88 33.27 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.467 -1.395 . . . . 0.0 111.454 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.4 p -151.14 129.78 12.28 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.162 -0.961 . . . . 0.0 111.918 -175.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -142.04 152.56 43.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.664 1.185 . . . . 0.0 112.302 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.79 -5.7 59.21 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -64.24 147.7 51.82 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.673 1.124 . . . . 0.0 109.548 169.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -129.96 160.28 65.95 Favored Pre-proline 0 N--CA 1.47 0.547 0 C-N-CA 124.755 1.222 . . . . 0.0 109.683 -171.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -52.14 -28.01 31.68 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.548 2.832 . . . . 0.0 117.602 -171.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -76.79 -1.36 27.74 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 129.506 3.123 . . . . 0.0 116.745 -170.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.226 0 CA-C-N 120.307 1.412 . . . . 0.0 113.685 -179.501 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.9 tttt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 34.1 tp -59.56 119.65 41.88 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.935 1.294 . . . . 0.0 111.507 -171.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -88.91 165.98 5.87 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.304 2.669 . . . . 0.0 113.152 -174.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -58.28 140.07 92.97 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.145 2.563 . . . . 0.0 113.248 -177.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.4 -18.14 15.78 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 118.263 -1.298 . . . . 0.0 114.175 -173.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -89.97 113.48 25.14 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 119.152 1.476 . . . . 0.0 110.387 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.88 165.01 33.85 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.82 145.32 7.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.952 1.301 . . . . 0.0 114.384 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.14 167.76 25.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.711 2.405 . . . . 0.0 110.222 -169.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 59.9 ttp -154.64 126.81 7.78 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.291 0.567 . . . . 0.0 112.358 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.4 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 73.6 m-85 -75.73 129.28 36.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.763 1.625 . . . . 0.0 109.589 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.19 -27.54 67.23 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -72.23 5.69 2.68 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.774 1.63 . . . . 0.0 113.691 169.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.87 62.54 0.97 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 125.26 1.41 . . . . 0.0 114.204 169.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.0 m -152.41 121.93 6.84 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.322 1.561 . . . . 0.0 111.865 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 38.5 t -94.66 138.21 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.512 1.125 . . . . 0.0 109.582 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -150.65 179.59 8.06 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.211 1.804 . . . . 0.0 109.772 -177.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.412 ' CE1' ' HA ' ' A' ' 30' ' ' ARG . 13.0 m-85 -111.16 135.07 52.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.687 1.195 . . . . 0.0 112.148 169.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -130.95 136.42 48.54 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.554 1.142 . . . . 0.0 111.938 -174.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -88.84 98.86 11.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.662 0.785 . . . . 0.0 110.618 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -76.04 25.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.4 mt -122.45 -40.01 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.127 1.371 . . . . 0.0 109.803 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -101.23 -22.11 14.73 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 79.58 8.01 1.75 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.05 2.94 . . . . 0.0 114.013 -170.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.16 153.28 30.67 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.256 0.935 . . . . 0.0 112.09 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -142.74 150.19 39.75 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.273 1.029 . . . . 0.0 112.232 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.37 136.29 32.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.601 1.161 . . . . 0.0 110.931 174.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -84.94 5.15 30.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.104 0.961 . . . . 0.0 113.503 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -80.55 153.6 27.98 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.247 2.219 . . . . 0.0 107.901 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HA ' ' CE1' ' A' ' 18' ' ' TYR . 31.6 mtt85 -130.03 89.59 45.05 Favored Pre-proline 0 N--CA 1.472 0.662 0 O-C-N 121.587 -0.696 . . . . 0.0 110.688 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -95.2 -176.06 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 124.809 3.673 . . . . 0.0 111.422 178.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 24.8 t -139.02 13.82 2.65 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 172.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.271 0 C-N-CA 124.456 1.027 . . . . 0.0 112.496 -178.355 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.4 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.435 HD21 ' CD2' ' A' ' 18' ' ' TYR . 1.4 pp -146.01 155.68 51.26 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.031 0.832 . . . . 0.0 112.525 174.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -70.63 168.31 23.08 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.231 2.621 . . . . 0.0 113.978 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -49.76 140.19 30.44 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.148 3.232 . . . . 0.0 114.082 169.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.5 -15.57 40.08 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-O 118.349 -1.251 . . . . 0.0 115.306 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -74.45 104.97 5.37 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.876 1.338 . . . . 0.0 109.115 170.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.96 149.88 49.63 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 110.81 -169.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -59.43 138.01 57.81 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.906 1.682 . . . . 0.0 114.38 -169.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.85 -175.73 4.24 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.585 1.954 . . . . 0.0 110.642 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 46.3 mtt -154.32 130.36 10.26 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.82 2.048 . . . . 0.0 109.227 -177.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -77.37 159.44 29.49 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.329 1.051 . . . . 0.0 110.937 170.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.92 -12.09 22.91 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -178.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -91.38 0.1 57.56 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.392 1.477 . . . . 0.0 113.212 171.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.19 15.19 52.44 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 124.914 1.245 . . . . 0.0 115.106 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 53.1 m -94.81 125.32 39.39 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 119.574 1.687 . . . . 0.0 109.617 -170.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 t -94.45 138.24 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.683 0.793 . . . . 0.0 109.245 -171.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.04 179.63 7.6 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.988 1.315 . . . . 0.0 109.386 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.435 ' CD2' HD21 ' A' ' 2' ' ' LEU . 17.0 m-85 -118.05 143.03 46.77 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.746 1.218 . . . . 0.0 110.853 170.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -129.89 122.11 27.99 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.801 1.64 . . . . 0.0 109.241 -170.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -72.28 91.39 1.31 Allowed 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 110.379 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.264 1.5 p-80 -73.88 26.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 177.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.9 mt -114.13 -20.12 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 126.011 1.724 . . . . 0.0 109.633 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.1 p -134.73 -21.28 1.72 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.227 1.411 . . . . 0.0 114.623 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 80.08 8.54 1.48 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.538 2.735 . . . . 0.0 114.018 -169.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.74 152.88 43.28 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.115 1.325 . . . . 0.0 111.461 172.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.9 p -147.06 138.23 23.95 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.213 -0.929 . . . . 0.0 112.64 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -150.03 153.55 36.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.562 0.745 . . . . 0.0 111.296 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -75.12 -10.48 59.51 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -65.77 148.58 51.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.748 0.819 . . . . 0.0 111.595 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.97 160.17 66.48 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 126.741 2.016 . . . . 0.0 112.148 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.68 -51.6 9.43 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.928 3.085 . . . . 0.0 117.061 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.2 p -65.28 81.0 0.05 Allowed 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 128.832 2.853 . . . . 0.0 114.287 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.97 0 C-N-CA 124.611 1.1 . . . . 0.0 111.597 176.677 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.454 HD21 ' CD2' ' A' ' 18' ' ' TYR . 3.3 pp -163.01 154.32 14.74 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.09 1.756 . . . . 0.0 109.613 169.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -88.82 170.09 5.29 Favored 'Trans proline' 0 CA--C 1.55 1.283 0 C-N-CA 123.434 2.756 . . . . 0.0 112.485 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.82 140.26 13.14 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.108 3.206 . . . . 0.0 114.004 170.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.19 -14.3 61.26 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.351 0.976 . . . . 0.0 114.563 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 44.8 m95 -90.0 116.19 27.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.696 1.198 . . . . 0.0 108.106 169.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -119.87 141.02 49.95 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.183 1.393 . . . . 0.0 111.288 -169.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 125.28 25.73 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.376 0.671 . . . . 0.0 111.58 -169.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.32 171.25 13.96 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.239 2.216 . . . . 0.0 110.975 -169.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.57 140.21 17.96 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 60.9 m-85 -79.56 156.32 27.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.194 1.398 . . . . 0.0 111.107 174.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.01 -16.01 58.37 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.6 p30 -83.24 -0.92 51.66 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.694 1.197 . . . . 0.0 113.327 170.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.81 13.77 52.07 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.916 1.246 . . . . 0.0 114.883 -178.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.1 m -94.79 119.26 33.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.61 1.705 . . . . 0.0 109.425 -170.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t -94.48 141.14 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-O 122.066 0.936 . . . . 0.0 110.008 -172.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -154.41 179.97 8.5 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.991 1.717 . . . . 0.0 109.256 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.454 ' CD2' HD21 ' A' ' 2' ' ' LEU . 27.9 m-85 -117.85 140.46 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.542 1.137 . . . . 0.0 109.892 172.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -125.89 120.37 30.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.043 1.337 . . . . 0.0 110.599 -169.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -73.28 97.33 2.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.806 0.842 . . . . 0.0 110.71 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -71.43 3.28 3.93 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.9 mp -96.89 -23.64 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 110.758 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -130.52 -20.68 2.91 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 78.28 6.72 2.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.227 2.611 . . . . 0.0 113.53 -169.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.95 156.5 27.65 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.651 1.114 . . . . 0.0 111.383 172.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -144.14 150.03 37.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.382 -0.824 . . . . 0.0 112.734 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -143.65 119.76 10.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.193 1.397 . . . . 0.0 109.666 -176.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -66.43 -35.74 81.06 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.05 141.04 57.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.828 1.251 . . . . 0.0 111.12 174.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.1 mtm105 -104.69 160.78 24.87 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.65 1.58 . . . . 0.0 112.811 -169.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -49.89 -43.1 42.63 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 124.295 3.33 . . . . 0.0 115.723 -173.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.0 m 142.86 -18.73 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.167 1 C-N-CA 133.939 4.895 . . . . 0.0 111.919 -176.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 C-N-CA 126.206 1.86 . . . . 0.0 110.312 169.88 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.402 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 82.9 tttt . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.51 119.86 31.93 Favored Pre-proline 0 CA--C 1.549 0.921 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.154 170.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.86 174.49 4.6 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 123.227 2.618 . . . . 0.0 113.857 176.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.76 129.6 17.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.969 3.112 . . . . 0.0 114.222 173.061 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.81 4.15 85.0 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.413 -1.215 . . . . 0.0 115.88 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -85.3 129.35 34.83 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.37 1.585 . . . . 0.0 111.731 173.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -123.29 158.63 30.53 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.841 2.057 . . . . 0.0 111.75 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.89 118.04 20.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.224 1.409 . . . . 0.0 109.223 170.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 tpp85 -125.38 170.41 11.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.343 1.857 . . . . 0.0 110.425 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -154.69 140.17 17.81 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.303 -0.873 . . . . 0.0 112.818 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -76.28 133.26 40.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.512 1.925 . . . . 0.0 109.714 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.02 -28.48 69.08 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -73.18 5.89 3.18 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.937 1.695 . . . . 0.0 113.748 170.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.11 64.77 1.08 Allowed Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.223 1.392 . . . . 0.0 114.794 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.1 m -153.08 132.12 12.59 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.435 1.617 . . . . 0.0 110.893 169.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.6 t -94.62 143.3 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.889 0.875 . . . . 0.0 109.937 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -149.69 -177.35 5.83 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.238 1.415 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.11 130.67 53.45 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.738 1.215 . . . . 0.0 108.98 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -124.91 140.03 53.3 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.245 1.418 . . . . 0.0 111.336 -169.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.54 104.41 16.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.358 0.663 . . . . 0.0 111.539 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -2.26 14.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.7 mm -91.55 -23.96 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.903 0.881 . . . . 0.0 111.447 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.1 p -133.6 -11.17 2.75 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -169.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 66.38 13.27 9.15 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.914 1.286 . . . . 0.0 113.101 -169.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.39 156.65 31.58 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.71 -1.244 . . . . 0.0 111.291 169.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.0 p -150.84 139.92 21.09 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.489 -0.757 . . . . 0.0 112.082 -178.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -136.67 155.77 49.44 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.111 1.364 . . . . 0.0 110.642 174.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -88.5 -17.48 30.22 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 171.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.35 131.46 45.36 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.166 0.894 . . . . 0.0 111.945 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.89 160.42 30.16 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 127.554 2.342 . . . . 0.0 113.473 -171.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -49.91 162.78 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.167 3.244 . . . . 0.0 115.879 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.1 m -162.7 21.58 0.09 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.491 1.516 . . . . 0.0 110.874 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 C-N-CA 127.608 2.528 . . . . 0.0 107.819 -169.321 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 22.6 tp -55.91 119.85 29.17 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.599 1.16 . . . . 0.0 110.141 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -80.08 159.91 23.73 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.686 2.257 . . . . 0.0 113.876 -169.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -47.14 132.33 18.32 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.338 3.358 . . . . 0.0 114.419 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.66 -14.1 20.05 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 118.36 -1.245 . . . . 0.0 115.431 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -90.44 142.0 28.18 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.426 1.613 . . . . 0.0 112.629 169.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -136.88 158.13 45.15 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.772 0.796 . . . . 0.0 112.335 169.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -77.4 137.05 38.48 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.092 1.357 . . . . 0.0 110.495 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.427 ' HA ' ' HE ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -143.45 169.34 17.87 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.007 1.323 . . . . 0.0 111.393 -171.814 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 42.1 ttp -154.66 138.42 16.18 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.193 0.521 . . . . 0.0 111.432 -179.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -74.21 136.43 42.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.464 1.506 . . . . 0.0 109.691 169.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.77 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -72.89 6.14 2.79 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.659 1.984 . . . . 0.0 114.075 170.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.99 67.34 1.17 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.541 1.543 . . . . 0.0 114.86 169.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 m -153.25 129.6 10.56 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.374 1.587 . . . . 0.0 110.793 169.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.7 t -94.63 141.68 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.943 0.897 . . . . 0.0 110.139 -173.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -149.1 179.86 7.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.171 1.388 . . . . 0.0 110.742 178.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -114.88 133.19 56.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.548 1.539 . . . . 0.0 110.703 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -123.02 116.21 23.15 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.042 1.737 . . . . 0.0 109.031 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -74.39 97.32 3.03 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.511 0.724 . . . . 0.0 110.086 174.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -69.58 3.35 2.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.3 mt -95.43 -20.1 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 119.25 0.932 . . . . 0.0 110.978 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -134.11 -20.04 1.94 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -171.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 79.04 5.92 2.22 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 129.161 2.984 . . . . 0.0 113.154 -169.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.32 129.86 41.59 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.86 1.209 . . . . 0.0 111.253 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.5 p -120.41 123.3 42.71 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.144 0.977 . . . . 0.0 111.769 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -133.11 146.32 51.51 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 110.235 179.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -81.87 -30.78 31.84 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.69 -0.631 . . . . 0.0 111.353 177.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.4 109.63 0.52 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.751 2.42 . . . . 0.0 110.27 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -72.68 110.41 8.21 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 124.747 1.219 . . . . 0.0 112.452 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -85.65 62.14 5.45 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.781 2.321 . . . . 0.0 112.747 -176.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.1 p 56.23 29.73 15.36 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 112.56 -2.109 . . . . 0.0 115.458 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.035 0 C-N-CA 125.693 1.616 . . . . 0.0 111.732 178.538 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 46.2 tp -57.55 119.67 34.6 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.711 0.804 . . . . 0.0 111.715 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -73.26 154.84 51.67 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 122.335 2.023 . . . . 0.0 113.122 175.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.37 130.39 21.02 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.394 2.729 . . . . 0.0 112.042 -175.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.95 -10.85 62.29 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.824 1.202 . . . . 0.0 114.267 -177.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -89.77 136.36 33.08 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 1.279 . . . . 0.0 111.458 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -133.57 137.03 45.3 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.958 1.703 . . . . 0.0 111.118 -169.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 140.23 54.31 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -169.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -144.23 176.26 9.47 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 127.451 2.301 . . . . 0.0 111.717 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 16.3 ttt -154.63 122.2 5.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.103 1.361 . . . . 0.0 109.35 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -70.0 159.33 33.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.81 1.244 . . . . 0.0 111.307 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.95 -16.19 58.5 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.0 p30 -85.91 -1.37 57.23 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.672 1.189 . . . . 0.0 113.312 170.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.78 14.38 49.93 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.45 1.5 . . . . 0.0 115.239 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.6 m -94.96 123.35 38.39 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.762 1.781 . . . . 0.0 109.705 -170.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.8 t -94.51 136.64 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 121.631 0.729 . . . . 0.0 109.589 -172.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -143.85 179.61 7.06 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.101 1.36 . . . . 0.0 109.822 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -122.76 143.52 49.77 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.096 1.359 . . . . 0.0 109.234 172.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -124.28 119.52 29.54 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.724 1.61 . . . . 0.0 110.633 -169.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -64.52 101.55 0.46 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.366 0.667 . . . . 0.0 109.992 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -75.41 3.64 8.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -97.46 -32.74 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.473 1.509 . . . . 0.0 110.214 174.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 32.0 p -119.09 -18.12 8.8 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 80.01 1.38 2.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 129.245 3.018 . . . . 0.0 114.38 -170.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.77 129.67 40.61 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.975 1.261 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.6 p -112.68 124.43 52.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.998 1.319 . . . . 0.0 111.541 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -141.11 150.33 42.72 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.868 0.842 . . . . 0.0 111.95 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -77.81 5.27 9.86 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.43 1.892 . . . . 0.0 113.8 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -75.15 109.66 8.83 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.187 -0.945 . . . . 0.0 110.801 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.36 160.43 28.44 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.916 1.687 . . . . 0.0 114.008 -169.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -52.91 169.59 0.36 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 125.02 3.813 . . . . 0.0 114.939 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.0 m 63.35 -31.41 0.1 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 128.169 2.588 . . . . 0.0 117.265 175.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.38 1.467 . . . . 0.0 111.422 178.497 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 62.04 153.65 0.11 Allowed Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.493 3.117 . . . . 0.0 115.159 -171.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -60.74 165.86 11.05 Favored 'Trans proline' 0 CA--C 1.552 1.378 0 C-N-CA 123.339 2.692 . . . . 0.0 113.792 172.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -43.74 101.47 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 1 C-N-CA 125.638 4.226 . . . . 0.0 116.379 -174.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.53 -5.97 84.16 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.067 1.318 . . . . 0.0 115.58 175.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -80.18 143.08 34.12 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.923 1.361 . . . . 0.0 112.101 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -157.6 160.57 38.24 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 110.302 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 144.48 52.52 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.366 1.867 . . . . 0.0 112.129 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -140.05 173.5 11.46 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.4 1.48 . . . . 0.0 111.617 171.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.7 ttt -154.69 117.25 4.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.571 1.548 . . . . 0.0 109.418 -178.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -67.59 156.95 35.58 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.69 1.196 . . . . 0.0 111.451 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -16.18 58.0 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -84.84 -1.53 56.58 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.627 1.171 . . . . 0.0 113.299 170.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.0 13.55 49.15 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 125.273 1.416 . . . . 0.0 115.274 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.7 m -94.88 119.63 33.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.694 1.747 . . . . 0.0 109.885 -169.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -94.43 140.34 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.898 0.856 . . . . 0.0 109.911 -173.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -151.12 179.9 7.88 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.381 1.472 . . . . 0.0 109.904 -177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -119.69 143.46 47.74 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.85 0.86 . . . . 0.0 109.594 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -131.52 140.06 49.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.631 1.572 . . . . 0.0 109.529 -173.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -98.38 94.96 7.03 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.681 0.792 . . . . 0.0 110.083 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.283 1.6 p-80 -74.82 20.18 0.13 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -178.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.4 mt -112.19 -17.66 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 C-N-CA 125.516 1.527 . . . . 0.0 110.183 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.8 p -135.18 -11.5 2.2 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -175.209 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.3 11.67 8.51 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.067 1.747 . . . . 0.0 113.659 -169.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.62 155.84 31.99 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.129 1.332 . . . . 0.0 111.869 170.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.8 p -150.55 140.48 21.93 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.05 0.94 . . . . 0.0 111.944 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -145.03 140.13 27.91 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.837 0.855 . . . . 0.0 112.799 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -77.74 -33.56 52.84 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.261 1.025 . . . . 0.0 112.299 170.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -61.76 109.74 1.31 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.226 1.01 . . . . 0.0 109.731 173.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -63.09 117.06 29.42 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -77.1 -177.52 3.89 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.929 3.086 . . . . 0.0 110.166 171.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 38.2 m -157.73 161.75 38.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.422 -1.424 . . . . 0.0 111.167 171.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 C-N-CA 127.053 2.263 . . . . 0.0 109.858 -173.321 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.708 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.3 mt -157.4 165.17 19.34 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 125.638 1.575 . . . . 0.0 110.92 169.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.76 139.89 48.19 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 123.561 2.84 . . . . 0.0 113.842 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -43.62 103.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.465 4.11 . . . . 0.0 115.675 -176.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 129.95 -41.77 1.5 Allowed Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.128 1.347 . . . . 0.0 112.567 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.62 151.26 21.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.265 1.033 . . . . 0.0 112.463 169.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -149.31 160.17 43.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -78.47 133.04 37.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.819 1.247 . . . . 0.0 110.132 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -128.36 177.94 6.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.899 2.08 . . . . 0.0 109.909 175.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -154.42 138.46 16.42 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.723 0.809 . . . . 0.0 111.159 170.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -76.68 138.1 39.81 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.678 1.591 . . . . 0.0 110.616 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.59 -24.41 65.44 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 122.613 0.365 . . . . 0.0 111.762 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -69.8 0.24 6.03 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 127.178 2.191 . . . . 0.0 113.092 169.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 85.84 60.65 1.75 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 124.671 1.129 . . . . 0.0 113.28 169.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 16.1 m -156.42 135.65 12.11 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.993 -1.298 . . . . 0.0 110.469 173.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -94.59 141.88 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 124.355 1.062 . . . . 0.0 108.711 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -149.55 179.5 7.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.713 0.768 . . . . 0.0 111.023 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -126.05 110.94 14.12 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 126.131 1.772 . . . . 0.0 110.891 -173.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -109.99 126.04 53.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 126.092 1.757 . . . . 0.0 111.816 -169.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -77.3 103.35 7.18 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.923 0.889 . . . . 0.0 109.148 169.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -75.93 15.22 0.56 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.2 mt -112.11 -39.99 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.003 1.321 . . . . 0.0 110.329 169.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.7 p -105.31 -20.0 13.63 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -177.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 79.46 2.79 2.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.821 2.848 . . . . 0.0 114.323 -171.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 129.96 44.3 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.605 1.093 . . . . 0.0 111.923 176.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -123.75 119.27 29.26 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.055 1.342 . . . . 0.0 111.438 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -119.74 144.2 47.39 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.068 0.947 . . . . 0.0 111.004 -176.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -90.22 -23.41 21.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.157 0.583 . . . . 0.0 111.012 170.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.45 109.75 0.43 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.919 2.488 . . . . 0.0 109.085 170.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -84.22 111.84 36.69 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 124.466 1.107 . . . . 0.0 112.414 -169.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -78.06 -138.0 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.78 3.653 . . . . 0.0 110.688 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.4 p -69.5 63.34 0.17 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.982 1.713 . . . . 0.0 113.88 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 C-N-CA 127.136 2.303 . . . . 0.0 114.357 171.084 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.9 tptm . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 118.051 -0.976 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 35.1 tp -56.27 119.5 28.15 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 124.763 1.225 . . . . 0.0 110.972 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.73 169.25 19.91 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.53 2.153 . . . . 0.0 112.646 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -64.08 140.03 69.94 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.733 2.289 . . . . 0.0 112.732 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.75 -13.57 52.29 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.372 -1.238 . . . . 0.0 114.9 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -84.83 128.9 34.83 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.183 1.393 . . . . 0.0 111.121 175.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -146.31 158.99 43.93 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.68 133.12 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.248 1.019 . . . . 0.0 111.98 -171.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.32 174.36 10.69 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.617 2.367 . . . . 0.0 110.444 -169.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.4 140.1 17.05 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.236 1.014 . . . . 0.0 111.228 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.401 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 54.3 m-85 -91.79 155.07 18.51 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.357 1.463 . . . . 0.0 110.686 173.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -15.23 51.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.3 p30 -84.98 -0.6 54.89 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.89 1.276 . . . . 0.0 113.4 171.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.4 12.99 53.29 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.658 1.123 . . . . 0.0 114.964 -177.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 m -94.7 118.63 32.04 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.41 1.605 . . . . 0.0 109.301 -170.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 t -94.59 142.47 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 123.965 0.906 . . . . 0.0 110.077 -177.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -155.02 179.56 9.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.386 1.874 . . . . 0.0 108.808 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CE1' ' HD2' ' A' ' 31' ' ' PRO . 16.2 m-85 -113.87 137.8 51.18 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.421 1.488 . . . . 0.0 109.911 169.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -126.44 127.34 45.26 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.773 1.229 . . . . 0.0 110.189 -171.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -82.99 99.72 10.0 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 122.743 0.417 . . . . 0.0 110.202 170.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.94 6.13 5.57 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 17.4 mt -93.46 -40.07 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 123.679 0.792 . . . . 0.0 109.909 169.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.9 p -105.65 -20.68 13.39 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 79.99 6.75 1.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.321 3.048 . . . . 0.0 113.83 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.27 155.15 39.58 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.524 1.057 . . . . 0.0 112.731 177.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -140.98 133.47 28.47 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.722 1.209 . . . . 0.0 112.167 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -132.6 123.05 25.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.232 1.813 . . . . 0.0 110.17 -175.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -77.55 -13.68 59.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 65.9 tt0 -58.67 142.82 48.58 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.495 0.718 . . . . 0.0 110.28 169.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -112.34 89.88 13.19 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.611 1.164 . . . . 0.0 111.084 176.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.4 ' HD2' ' CE1' ' A' ' 18' ' ' TYR . 42.2 Cg_endo -84.64 166.03 11.97 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.02 2.48 . . . . 0.0 110.912 169.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.7 p -104.18 -6.43 21.0 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.64 1.576 . . . . 0.0 113.556 172.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.306 0 C-N-CA 127.25 2.357 . . . . 0.0 110.05 -175.17 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.401 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 104.424 -2.435 . . . . 0.0 104.424 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.633 HD13 ' HB2' ' A' ' 6' ' ' TRP . 2.7 pp -148.41 157.12 42.37 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -169.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -90.06 168.62 4.45 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.455 3.437 . . . . 0.0 114.071 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.48 140.16 44.89 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.858 3.038 . . . . 0.0 112.422 169.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 115.39 -26.22 9.26 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.749 1.166 . . . . 0.0 112.046 -171.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.633 ' HB2' HD13 ' A' ' 2' ' ' LEU . 74.8 m95 -90.35 145.49 24.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.468 1.107 . . . . 0.0 110.642 169.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.07 150.69 44.66 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.274 1.03 . . . . 0.0 111.389 -176.47 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -75.6 136.95 40.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.989 1.316 . . . . 0.0 113.345 -169.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 45.5 mmt-85 -143.2 176.09 9.39 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.637 1.175 . . . . 0.0 112.194 -178.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.49 140.03 17.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.448 1.499 . . . . 0.0 110.783 175.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -81.74 159.3 23.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.82 1.248 . . . . 0.0 111.015 175.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.66 -14.92 49.16 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.1 p30 -87.19 -0.51 56.81 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.138 1.375 . . . . 0.0 113.266 171.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.2 14.36 51.59 Favored Glycine 0 CA--C 1.538 1.497 0 C-N-CA 124.896 1.236 . . . . 0.0 115.074 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -94.74 118.2 31.36 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.638 1.719 . . . . 0.0 109.423 -170.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.7 t -94.54 139.39 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.618 0.767 . . . . 0.0 109.788 -170.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -150.15 179.32 8.18 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.081 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -116.76 145.59 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 169.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -127.8 112.98 15.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.559 1.944 . . . . 0.0 109.995 -169.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -67.5 97.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.198 0.999 . . . . 0.0 110.672 172.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -72.31 4.35 3.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.79 -19.39 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.367 1.067 . . . . 0.0 110.354 173.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -136.44 -20.26 1.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -172.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 80.08 6.29 1.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.187 2.995 . . . . 0.0 113.491 -169.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.72 129.91 41.44 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.883 1.219 . . . . 0.0 111.55 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -117.56 127.35 53.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.731 1.212 . . . . 0.0 111.45 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -140.92 146.75 37.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.585 0.707 . . . . 0.0 111.971 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -78.13 -0.38 28.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.756 1.622 . . . . 0.0 114.5 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.08 157.57 25.35 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.703 0.801 . . . . 0.0 111.406 169.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.75 160.57 46.11 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.759 2.024 . . . . 0.0 110.17 -170.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.457 ' HG3' HD11 ' A' ' 2' ' ' LEU . 37.3 Cg_exo -51.47 -52.47 8.96 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.785 2.99 . . . . 0.0 113.388 174.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 t -93.26 -161.64 0.86 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.578 3.151 . . . . 0.0 110.885 171.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.347 0 C-N-CA 130.125 3.726 . . . . 0.0 116.957 175.498 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.3 tttt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -66.29 146.08 99.01 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-N 119.699 1.136 . . . . 0.0 111.017 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -80.79 172.35 13.32 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.976 2.451 . . . . 0.0 112.29 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -47.1 140.15 14.41 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 124.238 3.292 . . . . 0.0 115.313 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.98 -16.08 56.31 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.169 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -81.4 104.88 12.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.715 1.757 . . . . 0.0 110.615 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -133.89 149.93 51.34 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -170.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.538 ' HE3' ' H ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -53.21 128.15 26.96 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.533 1.933 . . . . 0.0 115.989 -169.786 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.18 173.25 12.39 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.949 2.5 . . . . 0.0 111.055 -171.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.68 140.06 17.71 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.263 1.025 . . . . 0.0 111.795 -171.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 52.8 m-85 -85.82 156.28 20.64 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 110.824 173.637 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.92 -14.49 47.41 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -86.37 -0.55 56.18 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.958 1.303 . . . . 0.0 113.38 171.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.29 14.14 52.0 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.688 1.137 . . . . 0.0 114.961 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.84 118.3 31.55 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.469 1.634 . . . . 0.0 109.231 -171.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.5 t -94.6 141.75 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.672 0.749 . . . . 0.0 110.214 -172.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -152.26 179.76 8.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.353 1.461 . . . . 0.0 110.361 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.403 ' CE1' ' HB3' ' A' ' 30' ' ' ARG . 14.8 m-85 -112.77 136.49 52.33 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 125.879 1.672 . . . . 0.0 110.426 171.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -123.44 124.52 43.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.591 1.556 . . . . 0.0 109.865 -169.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -75.96 97.95 4.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.918 0.487 . . . . 0.0 111.058 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -66.7 -4.86 9.91 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -178.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.4 mt -91.98 -20.46 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.476 1.11 . . . . 0.0 110.588 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.2 p -136.23 -21.8 1.37 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -171.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 79.59 7.73 1.78 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.488 2.715 . . . . 0.0 113.52 -169.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.03 159.48 17.07 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 119.646 1.112 . . . . 0.0 111.361 171.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.1 p -149.84 150.0 31.31 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.939 -1.101 . . . . 0.0 112.672 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -150.93 128.6 11.54 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.853 1.661 . . . . 0.0 109.785 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -67.39 -33.5 75.33 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.33 152.22 38.53 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.306 1.051 . . . . 0.0 113.009 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.403 ' HB3' ' CE1' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -130.01 160.62 64.33 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 126.679 1.992 . . . . 0.0 113.643 -169.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -49.97 160.58 1.25 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 124.028 3.152 . . . . 0.0 116.455 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.9 p 167.4 78.57 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.374 3.47 . . . . 0.0 106.196 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.767 -1.574 . . . . 0.0 111.079 -169.339 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' NAG . . . . . 0.407 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 109.646 -0.501 . . . . 0.0 109.646 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -147.99 179.94 7.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 124.651 1.18 . . . . 0.0 110.571 178.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.77 130.58 50.57 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.322 1.449 . . . . 0.0 108.382 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -120.57 127.95 52.62 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.518 1.927 . . . . 0.0 110.705 -169.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -78.87 93.05 4.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 123.897 0.879 . . . . 0.0 110.688 172.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.265 1.4 p-80 -73.1 22.66 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mt -110.99 -19.21 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 125.346 1.458 . . . . 0.0 109.949 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.4 p -134.01 -21.61 1.87 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.057 1.343 . . . . 0.0 114.515 -174.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 80.07 8.73 1.46 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 128.765 2.826 . . . . 0.0 114.053 -169.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.3 151.77 42.89 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.953 1.251 . . . . 0.0 111.835 173.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.5 p -142.97 130.57 21.28 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.294 1.038 . . . . 0.0 112.199 -176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 124.437 1.095 . . . . 0.0 110.967 -176.236 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 N--CA 1.468 0.443 0 CA-C-O 122.941 1.353 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -154.4 179.75 8.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 112.514 -2.13 . . . . 0.0 107.641 -176.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -119.48 141.26 49.33 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.135 0.974 . . . . 0.0 109.197 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -127.3 128.66 46.32 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.061 1.745 . . . . 0.0 109.705 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -88.36 105.47 17.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -75.98 5.61 6.34 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -101.54 -38.54 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 124.138 0.975 . . . . 0.0 110.329 170.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -106.46 -8.96 16.87 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -176.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.99 10.74 5.56 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.928 1.691 . . . . 0.0 113.792 -170.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.2 155.74 34.05 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 120.823 -1.173 . . . . 0.0 111.884 171.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.5 p -143.3 139.16 30.0 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.323 1.049 . . . . 0.0 111.023 175.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 C-N-CA 124.186 0.994 . . . . 0.0 111.5 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.5 t . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 121.245 0.545 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -148.95 179.56 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.22 1.008 . . . . 0.0 110.146 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -121.08 141.15 51.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.194 1.398 . . . . 0.0 109.845 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.22 116.96 22.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.787 1.635 . . . . 0.0 110.891 -169.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -67.36 96.23 0.48 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.329 1.052 . . . . 0.0 110.976 172.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -71.33 7.13 1.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.7 mt -96.1 -20.02 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.569 1.148 . . . . 0.0 110.444 172.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.6 p -136.09 -19.31 1.51 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -172.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 80.1 5.46 1.82 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.913 2.885 . . . . 0.0 113.634 -169.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.1 129.9 41.4 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.914 1.233 . . . . 0.0 111.962 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.7 p -117.59 122.41 43.55 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.093 1.357 . . . . 0.0 111.601 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 . . . . . 0 N--CA 1.471 0.614 0 C-N-CA 124.23 1.012 . . . . 0.0 112.667 -179.703 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t . . . . . 0 N--CA 1.471 0.602 0 CA-C-O 121.43 0.634 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -148.99 -174.52 4.66 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.403 1.881 . . . . 0.0 109.344 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -125.57 139.6 53.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.276 1.03 . . . . 0.0 109.621 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -135.6 128.59 31.45 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.935 1.294 . . . . 0.0 111.27 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -75.26 94.4 2.99 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.693 1.997 . . . . 0.0 110.851 170.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.256 1.9 p-80 -76.7 29.97 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -116.43 -22.37 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 125.662 1.585 . . . . 0.0 109.374 169.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -137.8 -17.08 1.27 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 80.08 -1.97 2.02 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 129.322 3.049 . . . . 0.0 113.976 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.66 129.57 39.68 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.549 1.068 . . . . 0.0 109.078 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.1 139.51 22.44 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.843 -0.535 . . . . 0.0 112.053 -169.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 125.435 1.494 . . . . 0.0 110.41 -174.259 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.471 0.585 0 CA-C-O 121.757 0.789 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -152.96 -179.28 7.53 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 126.154 1.782 . . . . 0.0 109.263 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -120.11 140.18 51.46 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.836 1.254 . . . . 0.0 109.564 170.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -123.28 117.05 24.39 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.024 0.93 . . . . 0.0 110.201 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -71.23 91.15 0.94 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.907 0.883 . . . . 0.0 109.947 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -72.3 8.18 1.45 Allowed 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.3 mt -93.7 -21.51 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.69 1.196 . . . . 0.0 110.451 170.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.8 p -138.2 -18.0 1.17 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -170.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 80.05 2.4 2.03 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.751 3.221 . . . . 0.0 113.9 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 129.9 41.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.078 1.308 . . . . 0.0 112.114 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 98.7 p -112.4 127.52 56.05 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.126 -0.984 . . . . 0.0 112.215 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 . . . . . 0 N--CA 1.467 0.402 0 C-N-CA 125.929 1.691 . . . . 0.0 110.152 -178.025 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.471 0.614 0 CA-C-O 121.758 0.79 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -152.54 179.89 8.19 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.538 1.935 . . . . 0.0 109.454 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -116.34 137.94 51.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 122.332 1.063 . . . . 0.0 111.237 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -124.34 119.26 28.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.959 1.704 . . . . 0.0 109.779 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.0 95.56 0.96 Allowed 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.231 1.012 . . . . 0.0 110.778 175.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -71.24 9.7 0.71 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -178.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.74 -20.8 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 125.141 1.377 . . . . 0.0 110.593 173.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -138.67 -5.61 1.54 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.087 1.355 . . . . 0.0 114.536 -171.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.322 0.2 OUTLIER 58.02 16.76 3.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.95 2.1 . . . . 0.0 114.706 -169.473 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.6 155.3 39.46 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 119.586 1.085 . . . . 0.0 110.704 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.6 p -147.95 128.43 14.04 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.219 -0.926 . . . . 0.0 112.505 -173.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 . . . . . 0 N--CA 1.467 0.408 0 C-N-CA 123.492 0.717 . . . . 0.0 112.638 174.958 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.4 t . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -151.95 179.44 8.46 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.636 1.174 . . . . 0.0 110.475 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -116.17 139.35 50.42 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.182 1.393 . . . . 0.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -123.23 114.84 20.79 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.681 1.992 . . . . 0.0 109.585 -169.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -68.84 101.01 1.26 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.827 0.851 . . . . 0.0 110.972 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -71.22 0.48 7.79 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.1 mt -94.04 -20.2 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.358 1.063 . . . . 0.0 110.565 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -135.19 -20.44 1.66 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 79.98 3.7 2.0 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 128.923 2.889 . . . . 0.0 113.514 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.24 136.76 57.91 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.796 1.18 . . . . 0.0 111.469 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.3 p -125.96 122.8 37.0 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.193 0.997 . . . . 0.0 111.636 -174.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 . . . . . 0 N--CA 1.467 0.416 0 C-N-CA 124.0 0.92 . . . . 0.0 112.166 -178.474 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.0 t . . . . . 0 N--CA 1.472 0.668 0 CA-C-O 121.653 0.74 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -153.65 -172.85 4.36 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.203 1.801 . . . . 0.0 110.16 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.53 137.89 54.38 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.968 1.307 . . . . 0.0 110.195 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -125.95 126.2 43.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.3 1.44 . . . . 0.0 110.224 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -80.97 94.89 6.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.664 0.785 . . . . 0.0 110.244 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -71.87 6.15 2.2 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.9 mm -95.58 -21.7 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.448 1.099 . . . . 0.0 111.304 170.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.9 p -136.75 -11.66 1.78 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -169.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 69.69 11.11 7.82 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.909 1.683 . . . . 0.0 113.546 -169.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 157.73 31.36 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 120.092 1.315 . . . . 0.0 111.899 169.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -147.93 134.81 20.12 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.274 -0.891 . . . . 0.0 112.106 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 . . . . . 0 N--CA 1.468 0.467 0 C-N-CA 125.211 1.404 . . . . 0.0 110.642 177.771 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.6 t . . . . . 0 N--CA 1.471 0.583 0 CA-C-O 121.847 0.832 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -141.96 179.67 6.74 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.423 1.889 . . . . 0.0 109.795 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -118.14 134.76 54.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.943 0.878 . . . . 0.0 110.136 176.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -121.94 130.61 53.47 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.127 1.771 . . . . 0.0 110.705 -169.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -82.72 101.44 10.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.436 0.694 . . . . 0.0 111.013 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -68.53 -4.91 16.82 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.2 mt -92.6 -19.91 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.443 1.097 . . . . 0.0 110.694 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.7 p -136.7 -11.06 1.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -170.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 66.55 12.53 8.8 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.177 1.391 . . . . 0.0 113.136 -170.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.88 33.27 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.467 -1.395 . . . . 0.0 111.454 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.4 p -151.14 129.78 12.28 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.162 -0.961 . . . . 0.0 111.918 -175.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 . . . . . 0 N--CA 1.468 0.45 0 C-N-CA 124.664 1.185 . . . . 0.0 112.302 -177.611 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 38.5 t . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -150.65 179.59 8.06 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.211 1.804 . . . . 0.0 109.772 -177.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -111.16 135.07 52.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.687 1.195 . . . . 0.0 112.148 169.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -130.95 136.42 48.54 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.554 1.142 . . . . 0.0 111.938 -174.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -88.84 98.86 11.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.662 0.785 . . . . 0.0 110.618 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -76.04 25.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.4 mt -122.45 -40.01 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.127 1.371 . . . . 0.0 109.803 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -101.23 -22.11 14.73 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 79.58 8.01 1.75 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.05 2.94 . . . . 0.0 114.013 -170.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.16 153.28 30.67 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.256 0.935 . . . . 0.0 112.09 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -142.74 150.19 39.75 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.273 1.029 . . . . 0.0 112.232 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.356 0 C-N-CA 124.601 1.161 . . . . 0.0 110.931 174.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 t . . . . . 0 N--CA 1.468 0.469 0 CA-C-O 121.52 0.676 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.04 179.63 7.6 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.988 1.315 . . . . 0.0 109.386 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -118.05 143.03 46.77 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.746 1.218 . . . . 0.0 110.853 170.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -129.89 122.11 27.99 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.801 1.64 . . . . 0.0 109.241 -170.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -72.28 91.39 1.31 Allowed 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 110.379 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.264 1.5 p-80 -73.88 26.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 177.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.9 mt -114.13 -20.12 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 126.011 1.724 . . . . 0.0 109.633 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.1 p -134.73 -21.28 1.72 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.227 1.411 . . . . 0.0 114.623 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 80.08 8.54 1.48 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.538 2.735 . . . . 0.0 114.018 -169.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.74 152.88 43.28 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.115 1.325 . . . . 0.0 111.461 172.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.9 p -147.06 138.23 23.95 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.213 -0.929 . . . . 0.0 112.64 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 123.562 0.745 . . . . 0.0 111.296 175.69 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 122.066 0.936 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -154.41 179.97 8.5 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.991 1.717 . . . . 0.0 109.256 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -117.85 140.46 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.542 1.137 . . . . 0.0 109.892 172.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -125.89 120.37 30.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.043 1.337 . . . . 0.0 110.599 -169.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -73.28 97.33 2.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.806 0.842 . . . . 0.0 110.71 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -71.43 3.28 3.93 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.9 mp -96.89 -23.64 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 110.758 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -130.52 -20.68 2.91 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 78.28 6.72 2.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.227 2.611 . . . . 0.0 113.53 -169.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.95 156.5 27.65 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.651 1.114 . . . . 0.0 111.383 172.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -144.14 150.03 37.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.382 -0.824 . . . . 0.0 112.734 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 . . . . . 0 CA--C 1.539 0.525 0 C-N-CA 125.193 1.397 . . . . 0.0 109.666 -176.723 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.472 0.659 0 CA-C-O 121.481 0.658 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -149.69 -177.35 5.83 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.238 1.415 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.11 130.67 53.45 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.738 1.215 . . . . 0.0 108.98 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -124.91 140.03 53.3 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.245 1.418 . . . . 0.0 111.336 -169.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.54 104.41 16.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.358 0.663 . . . . 0.0 111.539 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -2.26 14.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.7 mm -91.55 -23.96 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.903 0.881 . . . . 0.0 111.447 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.1 p -133.6 -11.17 2.75 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -169.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 66.38 13.27 9.15 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.914 1.286 . . . . 0.0 113.101 -169.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.39 156.65 31.58 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.71 -1.244 . . . . 0.0 111.291 169.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.0 p -150.84 139.92 21.09 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.489 -0.757 . . . . 0.0 112.082 -178.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 . . . . . 0 N--CA 1.468 0.463 0 C-N-CA 125.111 1.364 . . . . 0.0 110.642 174.517 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.473 0.677 0 CA-C-O 121.372 0.606 . . . . 0.0 110.139 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -149.1 179.86 7.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.171 1.388 . . . . 0.0 110.742 178.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -114.88 133.19 56.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.548 1.539 . . . . 0.0 110.703 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -123.02 116.21 23.15 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.042 1.737 . . . . 0.0 109.031 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -74.39 97.32 3.03 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.511 0.724 . . . . 0.0 110.086 174.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -69.58 3.35 2.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.3 mt -95.43 -20.1 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 119.25 0.932 . . . . 0.0 110.978 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -134.11 -20.04 1.94 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -171.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 79.04 5.92 2.22 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 129.161 2.984 . . . . 0.0 113.154 -169.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.32 129.86 41.59 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.86 1.209 . . . . 0.0 111.253 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.5 p -120.41 123.3 42.71 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.144 0.977 . . . . 0.0 111.769 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 . . . . . 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 110.235 179.054 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.8 t . . . . . 0 N--CA 1.471 0.603 0 CA-C-O 121.631 0.729 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -143.85 179.61 7.06 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.101 1.36 . . . . 0.0 109.822 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -122.76 143.52 49.77 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.096 1.359 . . . . 0.0 109.234 172.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -124.28 119.52 29.54 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.724 1.61 . . . . 0.0 110.633 -169.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -64.52 101.55 0.46 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.366 0.667 . . . . 0.0 109.992 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -75.41 3.64 8.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -97.46 -32.74 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.473 1.509 . . . . 0.0 110.214 174.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 32.0 p -119.09 -18.12 8.8 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 80.01 1.38 2.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 129.245 3.018 . . . . 0.0 114.38 -170.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.77 129.67 40.61 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.975 1.261 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.6 p -112.68 124.43 52.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.998 1.319 . . . . 0.0 111.541 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.868 0.842 . . . . 0.0 111.95 -179.047 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.469 0.523 0 CA-C-O 121.898 0.856 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -151.12 179.9 7.88 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.381 1.472 . . . . 0.0 109.904 -177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -119.69 143.46 47.74 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.85 0.86 . . . . 0.0 109.594 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -131.52 140.06 49.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.631 1.572 . . . . 0.0 109.529 -173.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -98.38 94.96 7.03 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.681 0.792 . . . . 0.0 110.083 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.283 1.6 p-80 -74.82 20.18 0.13 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.4 mt -112.19 -17.66 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 C-N-CA 125.516 1.527 . . . . 0.0 110.183 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.8 p -135.18 -11.5 2.2 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -175.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.3 11.67 8.51 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.067 1.747 . . . . 0.0 113.659 -169.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.62 155.84 31.99 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.129 1.332 . . . . 0.0 111.869 170.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.8 p -150.55 140.48 21.93 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.05 0.94 . . . . 0.0 111.944 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 . . . . . 0 CA--C 1.539 0.529 0 C-N-CA 123.837 0.855 . . . . 0.0 112.799 176.952 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.47 0.557 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -149.55 179.5 7.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.713 0.768 . . . . 0.0 111.023 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -126.05 110.94 14.12 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 126.131 1.772 . . . . 0.0 110.891 -173.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -109.99 126.04 53.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 126.092 1.757 . . . . 0.0 111.816 -169.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -77.3 103.35 7.18 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.923 0.889 . . . . 0.0 109.148 169.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -75.93 15.22 0.56 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.2 mt -112.11 -39.99 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.003 1.321 . . . . 0.0 110.329 169.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.7 p -105.31 -20.0 13.63 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -177.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 79.46 2.79 2.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.821 2.848 . . . . 0.0 114.323 -171.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 129.96 44.3 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.605 1.093 . . . . 0.0 111.923 176.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -123.75 119.27 29.26 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.055 1.342 . . . . 0.0 111.438 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 N--CA 1.465 0.317 0 C-N-CA 124.068 0.947 . . . . 0.0 111.004 -176.142 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 N--CA 1.469 0.507 0 CA-C-O 121.822 0.82 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -155.02 179.56 9.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.386 1.874 . . . . 0.0 108.808 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -113.87 137.8 51.18 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.421 1.488 . . . . 0.0 109.911 169.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -126.44 127.34 45.26 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.773 1.229 . . . . 0.0 110.189 -171.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -82.99 99.72 10.0 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 122.743 0.417 . . . . 0.0 110.202 170.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.94 6.13 5.57 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 17.4 mt -93.46 -40.07 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 123.679 0.792 . . . . 0.0 109.909 169.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.9 p -105.65 -20.68 13.39 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 79.99 6.75 1.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.321 3.048 . . . . 0.0 113.83 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.27 155.15 39.58 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.524 1.057 . . . . 0.0 112.731 177.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -140.98 133.47 28.47 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.722 1.209 . . . . 0.0 112.167 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 126.232 1.813 . . . . 0.0 110.17 -175.308 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.471 0.604 0 CA-C-O 121.491 0.662 . . . . 0.0 109.788 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -150.15 179.32 8.18 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.081 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -116.76 145.59 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 169.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -127.8 112.98 15.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.559 1.944 . . . . 0.0 109.995 -169.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -67.5 97.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.198 0.999 . . . . 0.0 110.672 172.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -72.31 4.35 3.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.79 -19.39 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.367 1.067 . . . . 0.0 110.354 173.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -136.44 -20.26 1.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -172.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 80.08 6.29 1.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.187 2.995 . . . . 0.0 113.491 -169.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.72 129.91 41.44 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.883 1.219 . . . . 0.0 111.55 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -117.56 127.35 53.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.731 1.212 . . . . 0.0 111.45 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 . . . . . 0 CA--C 1.538 0.494 0 CA-C-O 121.585 0.707 . . . . 0.0 111.971 178.624 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.5 t . . . . . 0 N--CA 1.469 0.519 0 CA-C-O 121.672 0.749 . . . . 0.0 110.214 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -152.26 179.76 8.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.353 1.461 . . . . 0.0 110.361 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -112.77 136.49 52.33 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 125.879 1.672 . . . . 0.0 110.426 171.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -123.44 124.52 43.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.591 1.556 . . . . 0.0 109.865 -169.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -75.96 97.95 4.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.918 0.487 . . . . 0.0 111.058 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -66.7 -4.86 9.91 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -178.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.4 mt -91.98 -20.46 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.476 1.11 . . . . 0.0 110.588 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.2 p -136.23 -21.8 1.37 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -171.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 79.59 7.73 1.78 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.488 2.715 . . . . 0.0 113.52 -169.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.03 159.48 17.07 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 119.646 1.112 . . . . 0.0 111.361 171.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.1 p -149.84 150.0 31.31 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.939 -1.101 . . . . 0.0 112.672 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 125.853 1.661 . . . . 0.0 109.785 -172.614 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.533 ' H3 ' ' CD ' ' A' ' 29' ' ' GLU . 36.2 mtmm . . . . . 0 N--CA 1.48 1.071 0 CA-C-O 117.651 -1.166 . . . . 0.0 109.881 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 33.3 mt 73.68 119.65 0.03 OUTLIER Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 129.254 3.022 . . . . 0.0 116.542 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -72.03 174.92 10.55 Favored 'Trans proline' 0 CA--C 1.552 1.395 0 C-N-CA 123.118 2.545 . . . . 0.0 111.253 169.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.63 130.13 25.38 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.785 2.99 . . . . 0.0 114.212 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.21 -7.16 81.71 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.645 1.117 . . . . 0.0 115.854 173.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.6 m95 -85.13 131.85 34.38 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.742 1.271 . . . . 0.0 111.316 176.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.1 tm-20 -148.17 157.05 43.28 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.827 0.851 . . . . 0.0 110.94 -176.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -67.6 140.94 56.92 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.753 2.021 . . . . 0.0 114.155 -169.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 mmt85 -143.55 -179.83 6.67 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 127.656 2.382 . . . . 0.0 110.641 175.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.5 140.28 18.1 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.282 1.033 . . . . 0.0 111.238 174.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -81.87 130.78 35.18 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.882 2.073 . . . . 0.0 109.3 171.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.1 -26.88 66.57 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -72.4 3.83 4.39 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 125.583 1.553 . . . . 0.0 113.691 169.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.83 61.82 0.99 Allowed Glycine 0 C--N 1.341 0.858 0 C-N-CA 125.521 1.534 . . . . 0.0 114.859 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.1 m -153.16 133.17 13.31 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-N 119.668 1.734 . . . . 0.0 111.294 170.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.6 t -94.71 141.29 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.259 1.024 . . . . 0.0 109.646 -177.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 47.1 p90 -147.99 179.94 7.37 Favored 'General case' 0 CA--C 1.528 0.119 0 C-N-CA 124.651 1.18 . . . . 0.0 110.571 178.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -126.77 130.58 50.57 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.322 1.449 . . . . 0.0 108.382 178.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -120.57 127.95 52.62 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.518 1.927 . . . . 0.0 110.705 -169.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -78.87 93.05 4.95 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 123.897 0.879 . . . . 0.0 110.688 172.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.265 1.4 p-80 -73.1 22.66 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.5 mt -110.99 -19.21 7.07 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 C-N-CA 125.346 1.458 . . . . 0.0 109.949 169.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.4 p -134.01 -21.61 1.87 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.057 1.343 . . . . 0.0 114.515 -174.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 80.07 8.73 1.46 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 128.765 2.826 . . . . 0.0 114.053 -169.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.3 151.77 42.89 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.953 1.251 . . . . 0.0 111.835 173.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.5 p -142.97 130.57 21.28 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.294 1.038 . . . . 0.0 112.199 -176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -148.65 154.28 39.46 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.437 1.095 . . . . 0.0 110.967 -176.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -85.23 4.95 32.31 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -178.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.533 ' CD ' ' H3 ' ' A' ' 1' ' ' LYS . 3.3 tm-20 -64.67 109.7 2.1 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.619 1.568 . . . . 0.0 110.219 -177.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -98.43 134.85 21.48 Favored Pre-proline 0 CA--C 1.549 0.938 0 N-CA-C 115.166 1.543 . . . . 0.0 115.166 -169.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -83.39 -155.02 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.214 1 C-N-CA 125.401 4.067 . . . . 0.0 110.202 169.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.5 p -61.22 -23.38 65.58 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 120.387 -1.446 . . . . 0.0 114.172 170.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.028 0 C-N-CA 127.036 2.255 . . . . 0.0 114.034 -176.088 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 29.1 tptp . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 118.371 -0.823 . . . . 0.0 109.347 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 52.2 mt -68.19 158.92 82.81 Favored Pre-proline 0 CA--C 1.552 1.056 0 CA-C-O 118.742 -0.647 . . . . 0.0 109.863 169.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.67 170.83 11.81 Favored 'Trans proline' 0 CA--C 1.55 1.29 0 C-N-CA 123.461 2.774 . . . . 0.0 113.832 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -43.52 108.92 0.12 Allowed 'Trans proline' 0 C--N 1.354 0.834 1 C-N-CA 125.315 4.01 . . . . 0.0 115.703 -178.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.23 0.64 89.92 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.002 -1.444 . . . . 0.0 115.379 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -86.34 144.49 27.33 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.872 1.836 . . . . 0.0 112.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.62 153.9 46.24 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.023 2.129 . . . . 0.0 110.176 -175.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.3 ptpt -100.03 128.98 46.04 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-N 119.18 0.9 . . . . 0.0 111.602 -175.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.75 178.02 7.08 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 121.154 -0.966 . . . . 0.0 110.97 -169.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . 0.413 ' HA ' ' HA ' ' A' ' 16' ' ' VAL . 60.2 ttm -154.32 121.06 5.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.678 1.991 . . . . 0.0 106.884 -173.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -67.71 161.74 25.3 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.766 1.226 . . . . 0.0 111.468 174.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.1 -11.6 14.98 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.5 p30 -93.34 0.39 56.9 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.538 1.535 . . . . 0.0 113.246 171.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.14 11.68 58.36 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 125.25 1.405 . . . . 0.0 115.281 -177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 50.1 m -95.01 118.83 32.49 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.723 1.761 . . . . 0.0 108.822 -169.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.413 ' HA ' ' HA ' ' A' ' 10' ' ' MET . 35.8 m -94.39 155.6 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-O 122.941 1.353 . . . . 0.0 111.582 -176.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -154.4 179.75 8.71 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 112.514 -2.13 . . . . 0.0 107.641 -176.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -119.48 141.26 49.33 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.135 0.974 . . . . 0.0 109.197 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -127.3 128.66 46.32 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.061 1.745 . . . . 0.0 109.705 -172.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -88.36 105.47 17.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 172.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -75.98 5.61 6.34 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 55.0 mt -101.54 -38.54 6.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 124.138 0.975 . . . . 0.0 110.329 170.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -106.46 -8.96 16.87 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -176.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 63.99 10.74 5.56 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.928 1.691 . . . . 0.0 113.792 -170.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.2 155.74 34.05 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 120.823 -1.173 . . . . 0.0 111.884 171.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 68.5 p -143.3 139.16 30.0 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.323 1.049 . . . . 0.0 111.023 175.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -143.05 146.4 33.79 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.186 0.994 . . . . 0.0 111.5 178.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -84.4 -22.26 30.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.213 1.005 . . . . 0.0 111.711 169.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -62.41 109.61 1.41 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.362 0.528 . . . . 0.0 110.353 171.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.88 111.67 12.31 Favored Pre-proline 0 CA--C 1.538 0.491 0 C-N-CA 124.537 1.135 . . . . 0.0 113.467 -175.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -86.67 84.11 1.06 Allowed 'Trans proline' 0 N--CA 1.453 -0.901 0 C-N-CA 122.739 2.293 . . . . 0.0 110.864 -176.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.1 p 76.79 -8.4 1.68 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 129.646 3.178 . . . . 0.0 115.657 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.308 0 CA-C-O 116.814 -2.103 . . . . 0.0 115.219 177.551 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 27.4 tp -146.74 119.61 4.95 Favored Pre-proline 0 CA--C 1.545 0.762 0 CA-C-N 119.596 1.089 . . . . 0.0 110.628 172.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -80.31 166.41 20.34 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 122.861 2.374 . . . . 0.0 113.114 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -51.8 134.21 47.22 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 124.0 3.133 . . . . 0.0 113.889 172.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.42 -2.3 85.46 Favored Glycine 0 CA--C 1.535 1.334 0 CA-C-O 118.606 -1.108 . . . . 0.0 115.574 175.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -90.1 131.18 36.1 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.073 1.437 . . . . 0.0 111.013 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -135.47 147.09 48.77 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.017 0.927 . . . . 0.0 112.676 -171.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 9.5 pttm -66.92 123.7 20.91 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 126.71 2.004 . . . . 0.0 115.065 -169.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -130.33 177.73 7.12 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.495 1.918 . . . . 0.0 110.86 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.4 ttm -154.48 127.74 8.43 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.301 1.04 . . . . 0.0 110.632 178.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 71.9 m-85 -71.42 131.42 43.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.712 1.605 . . . . 0.0 109.503 169.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.99 -28.01 67.33 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -174.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.6 p-10 -73.2 5.64 3.38 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.012 1.725 . . . . 0.0 113.689 170.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.54 63.82 1.07 Allowed Glycine 0 C--N 1.341 0.812 0 C-N-CA 125.608 1.575 . . . . 0.0 114.776 169.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 55.4 m -152.88 131.05 11.93 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.557 1.678 . . . . 0.0 111.199 170.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.5 t -94.69 142.4 13.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 123.846 0.858 . . . . 0.0 109.594 -177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.4 p90 -148.95 179.56 7.77 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.22 1.008 . . . . 0.0 110.146 177.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -121.08 141.15 51.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 125.194 1.398 . . . . 0.0 109.845 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.22 116.96 22.82 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 125.787 1.635 . . . . 0.0 110.891 -169.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -67.36 96.23 0.48 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.329 1.052 . . . . 0.0 110.976 172.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.7 p-80 -71.33 7.13 1.43 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.331 1.234 . . . . 0.0 114.331 -179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 40.7 mt -96.1 -20.02 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.569 1.148 . . . . 0.0 110.444 172.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.6 p -136.09 -19.31 1.51 Allowed 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -172.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 80.1 5.46 1.82 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 128.913 2.885 . . . . 0.0 113.634 -169.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.1 129.9 41.4 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 119.914 1.233 . . . . 0.0 111.962 178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.7 p -117.59 122.41 43.55 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.093 1.357 . . . . 0.0 111.601 -176.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -139.54 153.93 47.55 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.23 1.012 . . . . 0.0 112.667 -179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -83.1 5.07 23.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.251 1.42 . . . . 0.0 114.222 -177.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -68.7 109.84 4.01 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.655 -0.653 . . . . 0.0 111.128 170.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.447 ' CZ ' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -97.08 154.39 38.18 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 126.389 1.876 . . . . 0.0 109.424 175.01 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -49.88 -35.07 38.98 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 124.206 3.271 . . . . 0.0 115.156 173.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.7 m -67.57 94.48 0.42 Allowed 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 128.855 2.862 . . . . 0.0 111.733 173.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.175 0 CA-C-O 118.619 -1.101 . . . . 0.0 114.489 171.679 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.402 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 118.783 -0.627 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 18.7 mt -87.82 119.91 70.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-O 118.547 -0.739 . . . . 0.0 112.077 177.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -67.22 170.18 13.8 Favored 'Trans proline' 0 CA--C 1.551 1.337 0 C-N-CA 122.728 2.285 . . . . 0.0 112.339 169.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -49.69 131.78 29.54 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 123.828 3.019 . . . . 0.0 114.157 173.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.77 -5.88 80.37 Favored Glycine 0 CA--C 1.534 1.243 0 C-N-CA 124.501 1.048 . . . . 0.0 115.575 176.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 52.4 m95 -83.05 136.49 34.47 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.655 1.228 . . . . 0.0 111.68 174.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.3 163.15 40.03 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 123.208 0.603 . . . . 0.0 111.456 169.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -49.97 142.81 8.68 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 127.639 2.376 . . . . 0.0 113.448 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.22 171.71 16.5 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.518 2.327 . . . . 0.0 109.92 -174.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.63 140.03 17.73 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 121.531 0.681 . . . . 0.0 112.381 -177.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.404 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 72.8 m-85 -84.09 147.2 27.5 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.218 1.407 . . . . 0.0 110.082 173.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.09 -18.31 46.08 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -68.44 -12.87 61.8 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.634 1.174 . . . . 0.0 113.778 170.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 82.81 68.98 1.41 Allowed Glycine 0 CA--C 1.53 1.003 0 N-CA-C 108.84 -1.704 . . . . 0.0 108.84 -169.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 59.4 m -151.74 122.57 7.52 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 120.677 -1.484 . . . . 0.0 109.166 178.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.5 t -94.77 141.6 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 123.723 0.809 . . . . 0.0 110.248 -171.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -148.99 -174.52 4.66 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.403 1.881 . . . . 0.0 109.344 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -125.57 139.6 53.45 Favored 'General case' 0 C--N 1.331 -0.203 0 C-N-CA 124.276 1.03 . . . . 0.0 109.621 178.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -135.6 128.59 31.45 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.935 1.294 . . . . 0.0 111.27 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -75.26 94.4 2.99 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 126.693 1.997 . . . . 0.0 110.851 170.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.256 1.9 p-80 -76.7 29.97 0.13 Allowed 'General case' 0 CA--C 1.542 0.666 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.7 mt -116.43 -22.37 4.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 125.662 1.585 . . . . 0.0 109.374 169.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.2 p -137.8 -17.08 1.27 Allowed 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -173.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 80.08 -1.97 2.02 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 129.322 3.049 . . . . 0.0 113.976 -169.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.66 129.57 39.68 Favored 'General case' 0 C--N 1.349 0.557 0 CA-C-N 119.549 1.068 . . . . 0.0 109.078 178.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.1 139.51 22.44 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.843 -0.535 . . . . 0.0 112.053 -169.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -163.88 167.93 20.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.435 1.494 . . . . 0.0 110.41 -174.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -78.85 4.99 12.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.895 1.278 . . . . 0.0 113.287 175.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -51.64 109.58 0.37 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.351 1.86 . . . . 0.0 110.514 172.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 62.9 ttt-85 -98.79 152.1 37.69 Favored Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 125.516 1.526 . . . . 0.0 110.38 -171.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_exo -49.63 -73.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 123.822 3.015 . . . . 0.0 116.241 -170.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 35.6 m -179.06 174.01 1.11 Allowed 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 130.366 3.466 . . . . 0.0 109.847 178.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.107 -1.385 . . . . 0.0 112.013 -174.708 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.404 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 8.9 pttm . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.8 pp -161.65 157.53 21.17 Favored Pre-proline 0 CA--C 1.544 0.744 0 CA-C-O 118.574 -0.727 . . . . 0.0 112.242 -169.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -86.63 168.0 8.51 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 124.024 3.149 . . . . 0.0 113.211 177.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -47.37 140.19 15.78 Favored 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 124.628 3.552 . . . . 0.0 114.103 169.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 113.24 -37.4 3.63 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.183 1.373 . . . . 0.0 111.471 -174.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 -78.45 114.5 17.41 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.048 1.339 . . . . 0.0 110.335 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -119.88 139.5 52.29 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.937 0.895 . . . . 0.0 111.49 -171.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -56.99 123.11 14.0 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.771 1.629 . . . . 0.0 111.719 -173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.38 167.47 21.54 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 127.096 2.158 . . . . 0.0 111.389 -169.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -154.63 130.15 9.86 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.079 0.552 . . . . 0.0 111.17 -169.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -87.89 133.49 33.9 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.913 1.685 . . . . 0.0 109.783 173.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.91 -19.51 12.35 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 173.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.88 -9.79 10.99 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 127.827 2.451 . . . . 0.0 112.714 169.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.45 59.94 1.96 Allowed Glycine 0 C--N 1.34 0.805 0 C-N-CA 125.129 1.347 . . . . 0.0 110.951 -176.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 92.1 m -152.44 122.16 6.93 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.673 -1.487 . . . . 0.0 110.451 179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.0 t -94.86 143.57 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 123.986 0.914 . . . . 0.0 110.139 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -152.96 -179.28 7.53 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 126.154 1.782 . . . . 0.0 109.263 -177.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -120.11 140.18 51.46 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.836 1.254 . . . . 0.0 109.564 170.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -123.28 117.05 24.39 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.024 0.93 . . . . 0.0 110.201 -173.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -71.23 91.15 0.94 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.907 0.883 . . . . 0.0 109.947 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -72.3 8.18 1.45 Allowed 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 34.3 mt -93.7 -21.51 5.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 124.69 1.196 . . . . 0.0 110.451 170.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.8 p -138.2 -18.0 1.17 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 -170.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 80.05 2.4 2.03 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 129.751 3.221 . . . . 0.0 113.9 -169.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 129.9 41.38 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 120.078 1.308 . . . . 0.0 112.114 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 98.7 p -112.4 127.52 56.05 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.126 -0.984 . . . . 0.0 112.215 -175.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -122.56 124.63 43.98 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.929 1.691 . . . . 0.0 110.152 -178.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -80.62 -30.79 36.72 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 175.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.69 109.13 10.2 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-O 122.012 0.911 . . . . 0.0 108.967 -175.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 154.17 80.85 Favored Pre-proline 0 N--CA 1.473 0.697 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -169.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -84.11 -175.13 2.09 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.477 3.451 . . . . 0.0 110.344 169.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 98.4 p -75.34 65.49 1.65 Allowed 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.347 -0.845 . . . . 0.0 109.766 169.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.263 0 C-N-CA 125.0 1.286 . . . . 0.0 112.785 -172.973 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 119.407 -0.33 . . . . 0.0 111.834 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.445 HD21 ' CD2' ' A' ' 18' ' ' TYR . 3.1 pp -153.65 152.66 27.67 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 124.011 0.924 . . . . 0.0 110.525 169.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -83.79 165.45 13.65 Favored 'Trans proline' 0 CA--C 1.547 1.151 0 C-N-CA 123.217 2.611 . . . . 0.0 112.048 175.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -60.25 140.21 90.9 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 123.177 2.585 . . . . 0.0 112.493 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 106.17 -21.26 33.8 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 125.146 1.355 . . . . 0.0 113.654 -177.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -85.14 107.23 17.11 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.61 1.164 . . . . 0.0 109.999 171.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -119.92 149.65 41.76 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.038 0.935 . . . . 0.0 111.432 -169.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.19 118.41 5.04 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 128.465 2.706 . . . . 0.0 112.692 -171.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -133.48 168.2 19.06 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.924 2.089 . . . . 0.0 110.633 -172.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 24.8 ttt -154.72 131.97 11.08 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.885 -0.509 . . . . 0.0 111.379 -169.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 57.9 m-85 -83.71 156.02 22.81 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.354 1.462 . . . . 0.0 111.08 178.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.82 -16.08 56.83 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.784 1.402 . . . . 0.0 114.784 -178.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 56.5 p30 -83.94 -1.85 55.4 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.435 1.094 . . . . 0.0 113.435 170.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.98 11.38 53.23 Favored Glycine 0 CA--C 1.536 1.374 0 C-N-CA 124.867 1.222 . . . . 0.0 115.234 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 45.0 m -94.82 122.68 37.7 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.558 1.679 . . . . 0.0 109.931 -169.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.9 t -94.65 142.59 13.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 CA-C-O 121.758 0.79 . . . . 0.0 110.49 -176.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -152.54 179.89 8.19 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.538 1.935 . . . . 0.0 109.454 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.445 ' CD2' HD21 ' A' ' 2' ' ' LEU . 28.7 m-85 -116.34 137.94 51.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 122.332 1.063 . . . . 0.0 111.237 171.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -124.34 119.26 28.76 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 125.959 1.704 . . . . 0.0 109.779 -169.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.0 95.56 0.96 Allowed 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.231 1.012 . . . . 0.0 110.778 175.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -71.24 9.7 0.71 Allowed 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -178.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -101.74 -20.8 5.41 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 C-N-CA 125.141 1.377 . . . . 0.0 110.593 173.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -138.67 -5.61 1.54 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.087 1.355 . . . . 0.0 114.536 -171.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . 0.322 0.2 OUTLIER 58.02 16.76 3.96 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.95 2.1 . . . . 0.0 114.706 -169.473 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.6 155.3 39.46 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-N 119.586 1.085 . . . . 0.0 110.704 169.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.6 p -147.95 128.43 14.04 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 121.219 -0.926 . . . . 0.0 112.505 -173.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -146.02 161.98 38.91 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.492 0.717 . . . . 0.0 112.638 174.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -85.51 -10.16 56.41 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.97 149.78 49.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.165 0.893 . . . . 0.0 111.575 171.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HD3' ' H ' ' A' ' 30' ' ' ARG . 0.0 OUTLIER -130.41 162.33 55.15 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 127.641 2.376 . . . . 0.0 112.987 -169.529 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -49.84 171.39 0.09 OUTLIER 'Trans proline' 0 CA--C 1.54 0.819 0 C-N-CA 123.696 2.931 . . . . 0.0 113.799 172.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 54.1 p 68.17 -171.93 0.19 Allowed 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.394 1.478 . . . . 0.0 110.555 -169.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.271 0 C-N-CA 124.878 1.228 . . . . 0.0 114.301 -174.55 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.407 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 53.1 tttp . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 116.366 -1.778 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 11.3 tp -53.37 119.65 18.34 Favored Pre-proline 0 CA--C 1.55 0.944 0 CA-C-N 120.305 1.411 . . . . 0.0 111.355 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.53 157.44 58.87 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 122.085 1.856 . . . . 0.0 112.971 177.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.55 132.55 25.64 Favored 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 123.38 2.72 . . . . 0.0 112.725 -172.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.13 1.45 90.35 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 118.835 -0.981 . . . . 0.0 114.768 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -90.04 131.74 35.76 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.839 1.32 . . . . 0.0 110.517 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.17 141.13 51.56 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.089 1.756 . . . . 0.0 109.908 -169.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.37 143.81 48.45 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.863 -1.148 . . . . 0.0 112.928 -171.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.9 tpp85 -150.14 172.33 15.47 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.817 1.247 . . . . 0.0 111.561 -171.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 50.6 ttp -154.84 133.63 12.16 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.867 0.867 . . . . 0.0 110.154 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.44 159.82 33.34 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.004 0.522 . . . . 0.0 111.55 176.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.14 -17.87 59.18 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.7 p30 -84.78 -0.31 53.35 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.903 1.281 . . . . 0.0 113.611 170.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 97.14 11.64 51.83 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 125.076 1.322 . . . . 0.0 115.099 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 39.1 m -94.85 99.45 11.5 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 120.061 1.931 . . . . 0.0 110.553 -169.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 42.4 t -46.01 136.61 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.94 1.696 . . . . 0.0 114.266 169.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -151.95 179.44 8.46 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.636 1.174 . . . . 0.0 110.475 169.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -116.17 139.35 50.42 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 125.182 1.393 . . . . 0.0 110.746 169.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -123.23 114.84 20.79 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.681 1.992 . . . . 0.0 109.585 -169.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -68.84 101.01 1.26 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.827 0.851 . . . . 0.0 110.972 173.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 -71.22 0.48 7.79 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -177.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 41.1 mt -94.04 -20.2 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 124.358 1.063 . . . . 0.0 110.565 176.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.6 p -135.19 -20.44 1.66 Allowed 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -172.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 79.98 3.7 2.0 Allowed 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 128.923 2.889 . . . . 0.0 113.514 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.24 136.76 57.91 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 119.796 1.18 . . . . 0.0 111.469 179.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 92.3 p -125.96 122.8 37.0 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.193 0.997 . . . . 0.0 111.636 -174.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -134.96 148.37 49.99 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.0 0.92 . . . . 0.0 112.166 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -75.93 5.18 6.86 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.693 1.197 . . . . 0.0 113.998 174.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -54.84 109.92 0.58 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.87 1.268 . . . . 0.0 109.248 169.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.1 ttp-105 -110.56 112.11 56.76 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.237 1.015 . . . . 0.0 109.665 -175.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.34 178.94 5.51 Favored 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 123.815 3.01 . . . . 0.0 112.963 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 53.3 m -155.55 32.76 0.37 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.078 1.751 . . . . 0.0 109.453 169.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.423 0 C-N-CA 127.753 2.597 . . . . 0.0 110.125 -169.745 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.404 ' HB3' ' HE3' ' A' ' 1' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.463 HD21 ' CD2' ' A' ' 18' ' ' TYR . 2.8 pp -158.48 139.65 9.55 Favored Pre-proline 0 CA--C 1.546 0.797 0 C-N-CA 125.652 1.581 . . . . 0.0 110.098 169.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -81.37 172.36 12.71 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.911 3.074 . . . . 0.0 112.781 175.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -59.66 140.23 92.62 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.025 2.483 . . . . 0.0 111.337 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 111.63 -21.4 21.29 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.183 1.373 . . . . 0.0 112.505 -170.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -90.32 150.44 21.91 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.302 1.441 . . . . 0.0 111.031 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -145.12 152.27 39.8 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.272 1.029 . . . . 0.0 111.215 171.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.0 pttm -61.4 136.23 57.96 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.24 1.816 . . . . 0.0 111.62 175.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.6 tpt85 -145.51 173.96 11.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.146 1.378 . . . . 0.0 110.707 -169.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 54.1 ttm -154.39 140.02 17.95 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.384 1.474 . . . . 0.0 108.849 -177.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 50.3 m-85 -83.06 161.95 21.52 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.133 1.773 . . . . 0.0 111.449 176.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.87 -7.5 5.23 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.3 p30 -99.4 0.93 43.73 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.693 1.597 . . . . 0.0 113.145 172.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.01 12.34 56.6 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.553 1.073 . . . . 0.0 115.303 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 56.7 m -94.8 124.27 38.74 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.645 1.722 . . . . 0.0 109.477 -170.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 24.0 t -94.67 139.6 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 123.748 0.819 . . . . 0.0 110.954 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -153.65 -172.85 4.36 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.203 1.801 . . . . 0.0 110.16 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.463 ' CD2' HD21 ' A' ' 2' ' ' LEU . 54.7 m-85 -124.53 137.89 54.38 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 124.968 1.307 . . . . 0.0 110.195 173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -125.95 126.2 43.98 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.3 1.44 . . . . 0.0 110.224 -169.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -80.97 94.89 6.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.664 0.785 . . . . 0.0 110.244 174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -71.87 6.15 2.2 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.9 mm -95.58 -21.7 5.51 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 124.448 1.099 . . . . 0.0 111.304 170.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.9 p -136.75 -11.66 1.78 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.304 1.594 . . . . 0.0 115.304 -169.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 69.69 11.11 7.82 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 125.909 1.683 . . . . 0.0 113.546 -169.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.48 157.73 31.36 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 120.092 1.315 . . . . 0.0 111.899 169.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.2 p -147.93 134.81 20.12 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 121.274 -0.891 . . . . 0.0 112.106 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -135.23 148.86 49.74 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.211 1.404 . . . . 0.0 110.642 177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -82.35 -14.18 55.7 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 170.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -66.27 140.53 58.14 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 124.199 0.999 . . . . 0.0 112.08 177.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.02 160.53 32.0 Favored Pre-proline 0 CA--C 1.542 0.645 0 C-N-CA 128.467 2.707 . . . . 0.0 114.504 -169.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.22 174.13 0.19 Allowed 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.517 3.478 . . . . 0.0 115.692 170.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.9 m 66.04 74.37 0.36 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 127.652 2.381 . . . . 0.0 113.488 177.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 C-N-CA 124.242 0.925 . . . . 0.0 111.363 -173.156 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.407 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.1 mtmm . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.448 HD21 ' CD2' ' A' ' 18' ' ' TYR . 90.2 mt -141.85 119.66 7.57 Favored Pre-proline 0 CA--C 1.54 0.581 0 CA-C-N 119.475 1.034 . . . . 0.0 111.359 169.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -73.63 176.06 9.85 Favored 'Trans proline' 0 CA--C 1.551 1.372 0 C-N-CA 122.993 2.462 . . . . 0.0 111.277 169.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -48.71 120.54 5.4 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.159 3.239 . . . . 0.0 114.538 173.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.51 1.0 83.91 Favored Glycine 0 CA--C 1.533 1.214 0 N-CA-C 115.951 1.141 . . . . 0.0 115.951 172.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -86.44 123.38 31.6 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.348 1.574 . . . . 0.0 111.532 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -144.79 160.83 40.62 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 178.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.77 132.29 51.76 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 116.841 2.163 . . . . 0.0 116.841 -169.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.39 168.95 19.27 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.986 1.714 . . . . 0.0 109.956 -176.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.8 ttp -154.72 140.05 17.67 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 121.388 -0.82 . . . . 0.0 111.598 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -83.32 161.49 21.41 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.331 1.053 . . . . 0.0 111.458 172.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.23 -25.77 48.77 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.266 0.839 . . . . 0.0 113.266 173.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -68.8 19.4 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 126.531 1.933 . . . . 0.0 113.849 169.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 48.07 30.53 7.5 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 125.303 1.43 . . . . 0.0 113.463 -170.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.3 m -101.84 112.25 24.8 Favored 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 123.634 0.773 . . . . 0.0 108.951 -169.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 36.6 t -94.5 132.32 38.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 123.837 0.855 . . . . 0.0 110.272 -169.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -141.96 179.67 6.74 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 126.423 1.889 . . . . 0.0 109.795 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.448 ' CD2' HD21 ' A' ' 2' ' ' LEU . 40.1 m-85 -118.14 134.76 54.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.943 0.878 . . . . 0.0 110.136 176.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -121.94 130.61 53.47 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.127 1.771 . . . . 0.0 110.705 -169.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -82.72 101.44 10.87 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 123.436 0.694 . . . . 0.0 111.013 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -68.53 -4.91 16.82 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.2 mt -92.6 -19.91 6.69 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.443 1.097 . . . . 0.0 110.694 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 82.7 p -136.7 -11.06 1.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -170.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 66.55 12.53 8.8 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.177 1.391 . . . . 0.0 113.136 -170.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.88 33.27 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 120.467 -1.395 . . . . 0.0 111.454 169.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 77.4 p -151.14 129.78 12.28 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.162 -0.961 . . . . 0.0 111.918 -175.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -142.04 152.56 43.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.664 1.185 . . . . 0.0 112.302 -177.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -85.79 -5.7 59.21 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 -177.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -64.24 147.7 51.82 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.673 1.124 . . . . 0.0 109.548 169.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 52.5 mtt85 -129.96 160.28 65.95 Favored Pre-proline 0 N--CA 1.47 0.547 0 C-N-CA 124.755 1.222 . . . . 0.0 109.683 -171.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -52.14 -28.01 31.68 Favored 'Trans proline' 0 C--N 1.348 0.542 0 C-N-CA 123.548 2.832 . . . . 0.0 117.602 -171.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -76.79 -1.36 27.74 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 129.506 3.123 . . . . 0.0 116.745 -170.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.226 0 CA-C-N 120.307 1.412 . . . . 0.0 113.685 -179.501 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.9 tttt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.067 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 34.1 tp -59.56 119.65 41.88 Favored Pre-proline 0 CA--C 1.551 1.002 0 C-N-CA 124.935 1.294 . . . . 0.0 111.507 -171.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -88.91 165.98 5.87 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 123.304 2.669 . . . . 0.0 113.152 -174.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_endo -58.28 140.07 92.97 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.145 2.563 . . . . 0.0 113.248 -177.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.4 -18.14 15.78 Favored Glycine 0 CA--C 1.533 1.186 0 CA-C-O 118.263 -1.298 . . . . 0.0 114.175 -173.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -89.97 113.48 25.14 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 119.152 1.476 . . . . 0.0 110.387 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.88 165.01 33.85 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.82 145.32 7.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.952 1.301 . . . . 0.0 114.384 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.14 167.76 25.93 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.711 2.405 . . . . 0.0 110.222 -169.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 59.9 ttp -154.64 126.81 7.78 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.291 0.567 . . . . 0.0 112.358 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.4 ' CG ' ' H5 ' ' A' ' 101' ' ' NAG . 73.6 m-85 -75.73 129.28 36.83 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.763 1.625 . . . . 0.0 109.589 169.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.19 -27.54 67.23 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -72.23 5.69 2.68 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.774 1.63 . . . . 0.0 113.691 169.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.87 62.54 0.97 Allowed Glycine 0 C--N 1.342 0.905 0 C-N-CA 125.26 1.41 . . . . 0.0 114.204 169.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 42.0 m -152.41 121.93 6.84 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 119.322 1.561 . . . . 0.0 111.865 171.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 38.5 t -94.66 138.21 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.512 1.125 . . . . 0.0 109.582 179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.1 p90 -150.65 179.59 8.06 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.211 1.804 . . . . 0.0 109.772 -177.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.412 ' CE1' ' HA ' ' A' ' 30' ' ' ARG . 13.0 m-85 -111.16 135.07 52.22 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.687 1.195 . . . . 0.0 112.148 169.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -130.95 136.42 48.54 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.554 1.142 . . . . 0.0 111.938 -174.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -88.84 98.86 11.96 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 123.662 0.785 . . . . 0.0 110.618 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -76.04 25.24 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 28.4 mt -122.45 -40.01 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.127 1.371 . . . . 0.0 109.803 169.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 41.8 p -101.23 -22.11 14.73 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 79.58 8.01 1.75 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 129.05 2.94 . . . . 0.0 114.013 -170.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -62.16 153.28 30.67 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.256 0.935 . . . . 0.0 112.09 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 55.1 p -142.74 150.19 39.75 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.273 1.029 . . . . 0.0 112.232 -177.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.37 136.29 32.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.601 1.161 . . . . 0.0 110.931 174.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -84.94 5.15 30.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.104 0.961 . . . . 0.0 113.503 172.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -80.55 153.6 27.98 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.247 2.219 . . . . 0.0 107.901 168.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HA ' ' CE1' ' A' ' 18' ' ' TYR . 31.6 mtt85 -130.03 89.59 45.05 Favored Pre-proline 0 N--CA 1.472 0.662 0 O-C-N 121.587 -0.696 . . . . 0.0 110.688 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -95.2 -176.06 0.38 Allowed 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 124.809 3.673 . . . . 0.0 111.422 178.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 24.8 t -139.02 13.82 2.65 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 114.072 1.138 . . . . 0.0 114.072 172.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.271 0 C-N-CA 124.456 1.027 . . . . 0.0 112.496 -178.355 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.4 ' H5 ' ' CG ' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 CA-C-O 118.766 -0.635 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.435 HD21 ' CD2' ' A' ' 18' ' ' TYR . 1.4 pp -146.01 155.68 51.26 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.031 0.832 . . . . 0.0 112.525 174.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -70.63 168.31 23.08 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 123.231 2.621 . . . . 0.0 113.978 178.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -49.76 140.19 30.44 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 124.148 3.232 . . . . 0.0 114.082 169.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.5 -15.57 40.08 Favored Glycine 0 CA--C 1.533 1.2 0 CA-C-O 118.349 -1.251 . . . . 0.0 115.306 174.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 62.1 m95 -74.45 104.97 5.37 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.876 1.338 . . . . 0.0 109.115 170.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -126.96 149.88 49.63 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.118 0.967 . . . . 0.0 110.81 -169.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -59.43 138.01 57.81 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.906 1.682 . . . . 0.0 114.38 -169.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -138.85 -175.73 4.24 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.585 1.954 . . . . 0.0 110.642 175.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 46.3 mtt -154.32 130.36 10.26 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.82 2.048 . . . . 0.0 109.227 -177.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -77.37 159.44 29.49 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.329 1.051 . . . . 0.0 110.937 170.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.92 -12.09 22.91 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -178.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.8 p30 -91.38 0.1 57.56 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.392 1.477 . . . . 0.0 113.212 171.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.19 15.19 52.44 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 124.914 1.245 . . . . 0.0 115.106 -177.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 53.1 m -94.81 125.32 39.39 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 119.574 1.687 . . . . 0.0 109.617 -170.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 t -94.45 138.24 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 123.683 0.793 . . . . 0.0 109.245 -171.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.3 p90 -148.04 179.63 7.6 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.988 1.315 . . . . 0.0 109.386 175.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.435 ' CD2' HD21 ' A' ' 2' ' ' LEU . 17.0 m-85 -118.05 143.03 46.77 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 124.746 1.218 . . . . 0.0 110.853 170.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 57.8 t80 -129.89 122.11 27.99 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.801 1.64 . . . . 0.0 109.241 -170.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -72.28 91.39 1.31 Allowed 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 123.601 0.761 . . . . 0.0 110.379 173.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.264 1.5 p-80 -73.88 26.89 0.07 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.325 1.231 . . . . 0.0 114.325 177.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 50.9 mt -114.13 -20.12 6.29 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 C-N-CA 126.011 1.724 . . . . 0.0 109.633 169.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.1 p -134.73 -21.28 1.72 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.227 1.411 . . . . 0.0 114.623 -174.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 80.08 8.54 1.48 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 128.538 2.735 . . . . 0.0 114.018 -169.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.74 152.88 43.28 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 120.115 1.325 . . . . 0.0 111.461 172.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 80.9 p -147.06 138.23 23.95 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 121.213 -0.929 . . . . 0.0 112.64 -177.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -150.03 153.55 36.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.562 0.745 . . . . 0.0 111.296 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -75.12 -10.48 59.51 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 114.32 1.23 . . . . 0.0 114.32 -179.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -65.77 148.58 51.54 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.748 0.819 . . . . 0.0 111.595 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.97 160.17 66.48 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 126.741 2.016 . . . . 0.0 112.148 -175.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -55.68 -51.6 9.43 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.928 3.085 . . . . 0.0 117.061 -169.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.2 p -65.28 81.0 0.05 Allowed 'General case' 0 C--N 1.319 -0.746 0 C-N-CA 128.832 2.853 . . . . 0.0 114.287 -169.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.97 0 C-N-CA 124.611 1.1 . . . . 0.0 111.597 176.677 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.454 HD21 ' CD2' ' A' ' 18' ' ' TYR . 3.3 pp -163.01 154.32 14.74 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.09 1.756 . . . . 0.0 109.613 169.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -88.82 170.09 5.29 Favored 'Trans proline' 0 CA--C 1.55 1.283 0 C-N-CA 123.434 2.756 . . . . 0.0 112.485 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.82 140.26 13.14 Favored 'Trans proline' 0 CA--C 1.537 0.657 0 C-N-CA 124.108 3.206 . . . . 0.0 114.004 170.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 99.19 -14.3 61.26 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.351 0.976 . . . . 0.0 114.563 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 44.8 m95 -90.0 116.19 27.85 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.696 1.198 . . . . 0.0 108.106 169.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -119.87 141.02 49.95 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.183 1.393 . . . . 0.0 111.288 -169.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 125.28 25.73 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.376 0.671 . . . . 0.0 111.58 -169.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.32 171.25 13.96 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.239 2.216 . . . . 0.0 110.975 -169.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 28.7 ptm -154.57 140.21 17.96 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 178.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.402 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 60.9 m-85 -79.56 156.32 27.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.194 1.398 . . . . 0.0 111.107 174.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.01 -16.01 58.37 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.611 1.337 . . . . 0.0 114.611 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.6 p30 -83.24 -0.92 51.66 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.694 1.197 . . . . 0.0 113.327 170.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.81 13.77 52.07 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.916 1.246 . . . . 0.0 114.883 -178.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.1 m -94.79 119.26 33.09 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-N 119.61 1.705 . . . . 0.0 109.425 -170.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 t -94.48 141.14 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 CA-C-O 122.066 0.936 . . . . 0.0 110.008 -172.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -154.41 179.97 8.5 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.991 1.717 . . . . 0.0 109.256 -178.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.454 ' CD2' HD21 ' A' ' 2' ' ' LEU . 27.9 m-85 -117.85 140.46 49.68 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 124.542 1.137 . . . . 0.0 109.892 172.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -125.89 120.37 30.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.043 1.337 . . . . 0.0 110.599 -169.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -73.28 97.33 2.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.806 0.842 . . . . 0.0 110.71 173.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -71.43 3.28 3.93 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -176.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 4.9 mp -96.89 -23.64 4.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 C-N-CA 124.627 1.171 . . . . 0.0 110.758 176.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -130.52 -20.68 2.91 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 -172.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 78.28 6.72 2.52 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.227 2.611 . . . . 0.0 113.53 -169.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.95 156.5 27.65 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.651 1.114 . . . . 0.0 111.383 172.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 94.6 p -144.14 150.03 37.44 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.382 -0.824 . . . . 0.0 112.734 -175.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -143.65 119.76 10.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.193 1.397 . . . . 0.0 109.666 -176.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -66.43 -35.74 81.06 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 175.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.05 141.04 57.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.828 1.251 . . . . 0.0 111.12 174.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 7.1 mtm105 -104.69 160.78 24.87 Favored Pre-proline 0 CA--C 1.547 0.859 0 C-N-CA 125.65 1.58 . . . . 0.0 112.811 -169.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -49.89 -43.1 42.63 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 124.295 3.33 . . . . 0.0 115.723 -173.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.0 m 142.86 -18.73 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.167 1 C-N-CA 133.939 4.895 . . . . 0.0 111.919 -176.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 C-N-CA 126.206 1.86 . . . . 0.0 110.312 169.88 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.402 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 82.9 tttt . . . . . 0 N--CA 1.482 1.162 0 CA-C-O 117.732 -1.128 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.51 119.86 31.93 Favored Pre-proline 0 CA--C 1.549 0.921 0 CA-C-O 118.103 -0.951 . . . . 0.0 110.154 170.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.86 174.49 4.6 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 123.227 2.618 . . . . 0.0 113.857 176.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_exo -47.76 129.6 17.69 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.969 3.112 . . . . 0.0 114.222 173.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.81 4.15 85.0 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-O 118.413 -1.215 . . . . 0.0 115.88 176.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -85.3 129.35 34.83 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.37 1.585 . . . . 0.0 111.731 173.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -123.29 158.63 30.53 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.841 2.057 . . . . 0.0 111.75 -178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.89 118.04 20.55 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.224 1.409 . . . . 0.0 109.223 170.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.1 tpp85 -125.38 170.41 11.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.343 1.857 . . . . 0.0 110.425 -173.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -154.69 140.17 17.81 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.303 -0.873 . . . . 0.0 112.818 -178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -76.28 133.26 40.1 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.512 1.925 . . . . 0.0 109.714 170.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.02 -28.48 69.08 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 -176.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -73.18 5.89 3.18 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.937 1.695 . . . . 0.0 113.748 170.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 93.11 64.77 1.08 Allowed Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.223 1.392 . . . . 0.0 114.794 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 46.1 m -153.08 132.12 12.59 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 119.435 1.617 . . . . 0.0 110.893 169.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 3.6 t -94.62 143.3 12.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 123.889 0.875 . . . . 0.0 109.937 -176.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 48.1 p90 -149.69 -177.35 5.83 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.238 1.415 . . . . 0.0 109.758 176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.11 130.67 53.45 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 124.738 1.215 . . . . 0.0 108.98 178.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -124.91 140.03 53.3 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.245 1.418 . . . . 0.0 111.336 -169.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -97.54 104.41 16.44 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.358 0.663 . . . . 0.0 111.539 176.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -2.26 14.34 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 13.7 mm -91.55 -23.96 5.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 123.903 0.881 . . . . 0.0 111.447 173.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 77.1 p -133.6 -11.17 2.75 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.519 1.674 . . . . 0.0 115.519 -169.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 66.38 13.27 9.15 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 124.914 1.286 . . . . 0.0 113.101 -169.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.39 156.65 31.58 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.71 -1.244 . . . . 0.0 111.291 169.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 88.0 p -150.84 139.92 21.09 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.489 -0.757 . . . . 0.0 112.082 -178.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -136.67 155.77 49.44 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.111 1.364 . . . . 0.0 110.642 174.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -88.5 -17.48 30.22 Favored 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 113.477 0.918 . . . . 0.0 113.477 171.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.35 131.46 45.36 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.166 0.894 . . . . 0.0 111.945 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.89 160.42 30.16 Favored Pre-proline 0 CA--C 1.537 0.469 0 C-N-CA 127.554 2.342 . . . . 0.0 113.473 -171.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -49.91 162.78 0.64 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 124.167 3.244 . . . . 0.0 115.879 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.1 m -162.7 21.58 0.09 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.491 1.516 . . . . 0.0 110.874 175.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 C-N-CA 127.608 2.528 . . . . 0.0 107.819 -169.321 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 22.6 tp -55.91 119.85 29.17 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 124.599 1.16 . . . . 0.0 110.141 175.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -80.08 159.91 23.73 Favored 'Trans proline' 0 CA--C 1.545 1.026 0 C-N-CA 122.686 2.257 . . . . 0.0 113.876 -169.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -47.14 132.33 18.32 Favored 'Trans proline' 0 C--N 1.352 0.729 0 C-N-CA 124.338 3.358 . . . . 0.0 114.419 177.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 79.66 -14.1 20.05 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 118.36 -1.245 . . . . 0.0 115.431 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -90.44 142.0 28.18 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 119.426 1.613 . . . . 0.0 112.629 169.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -136.88 158.13 45.15 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.772 0.796 . . . . 0.0 112.335 169.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 18.9 ttmm -77.4 137.05 38.48 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 125.092 1.357 . . . . 0.0 110.495 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.427 ' HE ' ' HA ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -143.45 169.34 17.87 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.007 1.323 . . . . 0.0 111.393 -171.814 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 42.1 ttp -154.66 138.42 16.18 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 121.193 0.521 . . . . 0.0 111.432 -179.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -74.21 136.43 42.77 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.464 1.506 . . . . 0.0 109.691 169.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.61 -30.77 68.92 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -175.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -72.89 6.14 2.79 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.659 1.984 . . . . 0.0 114.075 170.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 90.99 67.34 1.17 Allowed Glycine 0 CA--C 1.528 0.847 0 C-N-CA 125.541 1.543 . . . . 0.0 114.86 169.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 m -153.25 129.6 10.56 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 119.374 1.587 . . . . 0.0 110.793 169.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.7 t -94.63 141.68 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 123.943 0.897 . . . . 0.0 110.139 -173.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -149.1 179.86 7.57 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.171 1.388 . . . . 0.0 110.742 178.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -114.88 133.19 56.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 125.548 1.539 . . . . 0.0 110.703 175.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -123.02 116.21 23.15 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 126.042 1.737 . . . . 0.0 109.031 -171.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -74.39 97.32 3.03 Favored 'General case' 0 N--CA 1.448 -0.55 0 C-N-CA 123.511 0.724 . . . . 0.0 110.086 174.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 -69.58 3.35 2.47 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 59.3 mt -95.43 -20.1 6.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 119.25 0.932 . . . . 0.0 110.978 171.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 73.6 p -134.11 -20.04 1.94 Allowed 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -171.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 79.04 5.92 2.22 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 129.161 2.984 . . . . 0.0 113.154 -169.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.32 129.86 41.59 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.86 1.209 . . . . 0.0 111.253 179.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.5 p -120.41 123.3 42.71 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.144 0.977 . . . . 0.0 111.769 -176.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -133.11 146.32 51.51 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 110.235 179.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -81.87 -30.78 31.84 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.69 -0.631 . . . . 0.0 111.353 177.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.4 109.63 0.52 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.751 2.42 . . . . 0.0 110.27 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -72.68 110.41 8.21 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 124.747 1.219 . . . . 0.0 112.452 -169.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -85.65 62.14 5.45 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.781 2.321 . . . . 0.0 112.747 -176.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.1 p 56.23 29.73 15.36 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 112.56 -2.109 . . . . 0.0 115.458 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.035 0 C-N-CA 125.693 1.616 . . . . 0.0 111.732 178.538 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.0 mtmm . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 46.2 tp -57.55 119.67 34.6 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 123.711 0.804 . . . . 0.0 111.715 -172.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -73.26 154.84 51.67 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 122.335 2.023 . . . . 0.0 113.122 175.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -68.37 130.39 21.02 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 123.394 2.729 . . . . 0.0 112.042 -175.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.95 -10.85 62.29 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 124.824 1.202 . . . . 0.0 114.267 -177.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 6.7 m-90 -89.77 136.36 33.08 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 118.757 1.279 . . . . 0.0 111.458 174.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -133.57 137.03 45.3 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.958 1.703 . . . . 0.0 111.118 -169.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.48 140.23 54.31 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -169.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mmt85 -144.23 176.26 9.47 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 127.451 2.301 . . . . 0.0 111.717 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 16.3 ttt -154.63 122.2 5.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.103 1.361 . . . . 0.0 109.35 -178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -70.0 159.33 33.98 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.81 1.244 . . . . 0.0 111.307 177.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.95 -16.19 58.5 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.755 1.391 . . . . 0.0 114.755 -178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.0 p30 -85.91 -1.37 57.23 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 124.672 1.189 . . . . 0.0 113.312 170.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.78 14.38 49.93 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.45 1.5 . . . . 0.0 115.239 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 60.6 m -94.96 123.35 38.39 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 119.762 1.781 . . . . 0.0 109.705 -170.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.8 t -94.51 136.64 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 CA-C-O 121.631 0.729 . . . . 0.0 109.589 -172.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -143.85 179.61 7.06 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.101 1.36 . . . . 0.0 109.822 177.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -122.76 143.52 49.77 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.096 1.359 . . . . 0.0 109.234 172.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -124.28 119.52 29.54 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.724 1.61 . . . . 0.0 110.633 -169.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -64.52 101.55 0.46 Allowed 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.366 0.667 . . . . 0.0 109.992 171.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 -75.41 3.64 8.79 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -178.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -97.46 -32.74 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 125.473 1.509 . . . . 0.0 110.214 174.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 32.0 p -119.09 -18.12 8.8 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.4 m-80 80.01 1.38 2.06 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 129.245 3.018 . . . . 0.0 114.38 -170.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.77 129.67 40.61 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 119.975 1.261 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 81.6 p -112.68 124.43 52.54 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.998 1.319 . . . . 0.0 111.541 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -141.11 150.33 42.72 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.868 0.842 . . . . 0.0 111.95 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -77.81 5.27 9.86 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.43 1.892 . . . . 0.0 113.8 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -75.15 109.66 8.83 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.187 -0.945 . . . . 0.0 110.801 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.36 160.43 28.44 Favored Pre-proline 0 CA--C 1.543 0.674 0 C-N-CA 125.916 1.687 . . . . 0.0 114.008 -169.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -52.91 169.59 0.36 Allowed 'Trans proline' 0 CA--C 1.537 0.636 0 C-N-CA 125.02 3.813 . . . . 0.0 114.939 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.0 m 63.35 -31.41 0.1 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 128.169 2.588 . . . . 0.0 117.265 175.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 C-N-CA 125.38 1.467 . . . . 0.0 111.422 178.497 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 62.04 153.65 0.11 Allowed Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.493 3.117 . . . . 0.0 115.159 -171.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -60.74 165.86 11.05 Favored 'Trans proline' 0 CA--C 1.552 1.378 0 C-N-CA 123.339 2.692 . . . . 0.0 113.792 172.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -43.74 101.47 0.04 OUTLIER 'Trans proline' 0 CA--C 1.54 0.784 1 C-N-CA 125.638 4.226 . . . . 0.0 116.379 -174.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.53 -5.97 84.16 Favored Glycine 0 CA--C 1.531 1.085 0 C-N-CA 125.067 1.318 . . . . 0.0 115.58 175.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -80.18 143.08 34.12 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.923 1.361 . . . . 0.0 112.101 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -157.6 160.57 38.24 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.159 0.984 . . . . 0.0 110.302 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 144.48 52.52 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.366 1.867 . . . . 0.0 112.129 -179.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.2 mmp_? -140.05 173.5 11.46 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 125.4 1.48 . . . . 0.0 111.617 171.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 25.7 ttt -154.69 117.25 4.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.571 1.548 . . . . 0.0 109.418 -178.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -67.59 156.95 35.58 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.69 1.196 . . . . 0.0 111.451 176.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.9 -16.18 58.0 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.1 p30 -84.84 -1.53 56.58 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.627 1.171 . . . . 0.0 113.299 170.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 96.0 13.55 49.15 Favored Glycine 0 CA--C 1.535 1.315 0 C-N-CA 125.273 1.416 . . . . 0.0 115.274 -178.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.7 m -94.88 119.63 33.77 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.694 1.747 . . . . 0.0 109.885 -169.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.4 t -94.43 140.34 16.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-O 121.898 0.856 . . . . 0.0 109.911 -173.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -151.12 179.9 7.88 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.381 1.472 . . . . 0.0 109.904 -177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -119.69 143.46 47.74 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 123.85 0.86 . . . . 0.0 109.594 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -131.52 140.06 49.42 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.631 1.572 . . . . 0.0 109.529 -173.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -98.38 94.96 7.03 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.681 0.792 . . . . 0.0 110.083 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . 0.283 1.6 p-80 -74.82 20.18 0.13 Allowed 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 114.553 1.316 . . . . 0.0 114.553 -178.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 54.4 mt -112.19 -17.66 8.23 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.978 0 C-N-CA 125.516 1.527 . . . . 0.0 110.183 169.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 81.8 p -135.18 -11.5 2.2 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -175.209 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.3 11.67 8.51 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.067 1.747 . . . . 0.0 113.659 -169.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.62 155.84 31.99 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 120.129 1.332 . . . . 0.0 111.869 170.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 64.8 p -150.55 140.48 21.93 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.05 0.94 . . . . 0.0 111.944 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -145.03 140.13 27.91 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.837 0.855 . . . . 0.0 112.799 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -77.74 -33.56 52.84 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.261 1.025 . . . . 0.0 112.299 170.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -61.76 109.74 1.31 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.226 1.01 . . . . 0.0 109.731 173.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . 0.258 0.0 OUTLIER -63.09 117.06 29.42 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 113.053 0.761 . . . . 0.0 113.053 -173.284 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -77.1 -177.52 3.89 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.929 3.086 . . . . 0.0 110.166 171.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 38.2 m -157.73 161.75 38.52 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.422 -1.424 . . . . 0.0 111.167 171.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 C-N-CA 127.053 2.263 . . . . 0.0 109.858 -173.321 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.708 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.3 mt -157.4 165.17 19.34 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 125.638 1.575 . . . . 0.0 110.92 169.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.76 139.89 48.19 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 123.561 2.84 . . . . 0.0 113.842 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -43.62 103.55 0.05 OUTLIER 'Trans proline' 0 C--N 1.355 0.878 1 C-N-CA 125.465 4.11 . . . . 0.0 115.675 -176.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 129.95 -41.77 1.5 Allowed Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.128 1.347 . . . . 0.0 112.567 179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.62 151.26 21.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.265 1.033 . . . . 0.0 112.463 169.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -149.31 160.17 43.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 169.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.8 ttmm -78.47 133.04 37.48 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.819 1.247 . . . . 0.0 110.132 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.2 mmp_? -128.36 177.94 6.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.899 2.08 . . . . 0.0 109.909 175.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -154.42 138.46 16.42 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.723 0.809 . . . . 0.0 111.159 170.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -76.68 138.1 39.81 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.678 1.591 . . . . 0.0 110.616 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.59 -24.41 65.44 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 122.613 0.365 . . . . 0.0 111.762 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -69.8 0.24 6.03 Favored 'General case' 0 CA--C 1.556 1.189 0 C-N-CA 127.178 2.191 . . . . 0.0 113.092 169.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 85.84 60.65 1.75 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 124.671 1.129 . . . . 0.0 113.28 169.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 16.1 m -156.42 135.65 12.11 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.993 -1.298 . . . . 0.0 110.469 173.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.3 t -94.59 141.88 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 C-N-CA 124.355 1.062 . . . . 0.0 108.711 178.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 50.1 p90 -149.55 179.5 7.92 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 121.713 0.768 . . . . 0.0 111.023 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -126.05 110.94 14.12 Favored 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 126.131 1.772 . . . . 0.0 110.891 -173.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -109.99 126.04 53.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 126.092 1.757 . . . . 0.0 111.816 -169.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -77.3 103.35 7.18 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.923 0.889 . . . . 0.0 109.148 169.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 8.1 p-80 -75.93 15.22 0.56 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 52.2 mt -112.11 -39.99 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.003 1.321 . . . . 0.0 110.329 169.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.7 p -105.31 -20.0 13.63 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -177.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 79.46 2.79 2.25 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.821 2.848 . . . . 0.0 114.323 -171.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.18 129.96 44.3 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.605 1.093 . . . . 0.0 111.923 176.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -123.75 119.27 29.26 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.055 1.342 . . . . 0.0 111.438 -174.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -119.74 144.2 47.39 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.068 0.947 . . . . 0.0 111.004 -176.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -90.22 -23.41 21.27 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.157 0.583 . . . . 0.0 111.012 170.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.45 109.75 0.43 Allowed 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.919 2.488 . . . . 0.0 109.085 170.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -84.22 111.84 36.69 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 124.466 1.107 . . . . 0.0 112.414 -169.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -78.06 -138.0 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.78 3.653 . . . . 0.0 110.688 178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.4 p -69.5 63.34 0.17 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.982 1.713 . . . . 0.0 113.88 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.036 0 C-N-CA 127.136 2.303 . . . . 0.0 114.357 171.084 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.9 tptm . . . . . 0 N--CA 1.482 1.138 0 CA-C-O 118.051 -0.976 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 35.1 tp -56.27 119.5 28.15 Favored Pre-proline 0 CA--C 1.551 1.016 0 C-N-CA 124.763 1.225 . . . . 0.0 110.972 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -78.73 169.25 19.91 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.53 2.153 . . . . 0.0 112.646 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -64.08 140.03 69.94 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.733 2.289 . . . . 0.0 112.732 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.75 -13.57 52.29 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.372 -1.238 . . . . 0.0 114.9 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -84.83 128.9 34.83 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.183 1.393 . . . . 0.0 111.121 175.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -146.31 158.99 43.93 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 177.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.68 133.12 50.42 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.248 1.019 . . . . 0.0 111.98 -171.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.32 174.36 10.69 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 127.617 2.367 . . . . 0.0 110.444 -169.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.4 140.1 17.05 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.236 1.014 . . . . 0.0 111.228 -176.609 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.401 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 54.3 m-85 -91.79 155.07 18.51 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.357 1.463 . . . . 0.0 110.686 173.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.7 -15.23 51.72 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 114.872 1.434 . . . . 0.0 114.872 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.3 p30 -84.98 -0.6 54.89 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 124.89 1.276 . . . . 0.0 113.4 171.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 95.4 12.99 53.29 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.658 1.123 . . . . 0.0 114.964 -177.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.5 m -94.7 118.63 32.04 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.41 1.605 . . . . 0.0 109.301 -170.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.8 t -94.59 142.47 13.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 123.965 0.906 . . . . 0.0 110.077 -177.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 33.3 p90 -155.02 179.56 9.02 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.386 1.874 . . . . 0.0 108.808 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.4 ' CE1' ' HD2' ' A' ' 31' ' ' PRO . 16.2 m-85 -113.87 137.8 51.18 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.421 1.488 . . . . 0.0 109.911 169.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -126.44 127.34 45.26 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.773 1.229 . . . . 0.0 110.189 -171.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -82.99 99.72 10.0 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 122.743 0.417 . . . . 0.0 110.202 170.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.94 6.13 5.57 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.043 1.498 . . . . 0.0 115.043 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 17.4 mt -93.46 -40.07 11.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 123.679 0.792 . . . . 0.0 109.909 169.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 36.9 p -105.65 -20.68 13.39 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 14.7 m-80 79.99 6.75 1.73 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 129.321 3.048 . . . . 0.0 113.83 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.27 155.15 39.58 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 119.524 1.057 . . . . 0.0 112.731 177.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 87.9 p -140.98 133.47 28.47 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.722 1.209 . . . . 0.0 112.167 -175.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -132.6 123.05 25.7 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.232 1.813 . . . . 0.0 110.17 -175.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -77.55 -13.68 59.85 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 65.9 tt0 -58.67 142.82 48.58 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.495 0.718 . . . . 0.0 110.28 169.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -112.34 89.88 13.19 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.611 1.164 . . . . 0.0 111.084 176.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.4 ' HD2' ' CE1' ' A' ' 18' ' ' TYR . 42.2 Cg_endo -84.64 166.03 11.97 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 123.02 2.48 . . . . 0.0 110.912 169.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.7 p -104.18 -6.43 21.0 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.64 1.576 . . . . 0.0 113.556 172.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.306 0 C-N-CA 127.25 2.357 . . . . 0.0 110.05 -175.17 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.401 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.9 mmtm . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 104.424 -2.435 . . . . 0.0 104.424 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.633 HD13 ' HB2' ' A' ' 6' ' ' TRP . 2.7 pp -148.41 157.12 42.37 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -169.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -90.06 168.62 4.45 Favored 'Trans proline' 0 CA--C 1.549 1.258 0 C-N-CA 124.455 3.437 . . . . 0.0 114.071 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.48 140.16 44.89 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.858 3.038 . . . . 0.0 112.422 169.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 115.39 -26.22 9.26 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 124.749 1.166 . . . . 0.0 112.046 -171.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.633 ' HB2' HD13 ' A' ' 2' ' ' LEU . 74.8 m95 -90.35 145.49 24.92 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.468 1.107 . . . . 0.0 110.642 169.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.07 150.69 44.66 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.274 1.03 . . . . 0.0 111.389 -176.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 7.1 ptpp? -75.6 136.95 40.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.989 1.316 . . . . 0.0 113.345 -169.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 45.5 mmt-85 -143.2 176.09 9.39 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.637 1.175 . . . . 0.0 112.194 -178.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.49 140.03 17.86 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.448 1.499 . . . . 0.0 110.783 175.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -81.74 159.3 23.9 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.82 1.248 . . . . 0.0 111.015 175.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.66 -14.92 49.16 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 54.1 p30 -87.19 -0.51 56.81 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.138 1.375 . . . . 0.0 113.266 171.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.2 14.36 51.59 Favored Glycine 0 CA--C 1.538 1.497 0 C-N-CA 124.896 1.236 . . . . 0.0 115.074 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 37.1 m -94.74 118.2 31.36 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 119.638 1.719 . . . . 0.0 109.423 -170.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.7 t -94.54 139.39 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 123.618 0.767 . . . . 0.0 109.788 -170.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 49.2 p90 -150.15 179.32 8.18 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.081 -179.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -116.76 145.59 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 169.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -127.8 112.98 15.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.559 1.944 . . . . 0.0 109.995 -169.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -67.5 97.93 0.62 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.198 0.999 . . . . 0.0 110.672 172.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -72.31 4.35 3.78 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 49.7 mt -93.79 -19.39 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.875 0 C-N-CA 124.367 1.067 . . . . 0.0 110.354 173.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 71.5 p -136.44 -20.26 1.39 Allowed 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.154 1.538 . . . . 0.0 115.154 -172.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 80.08 6.29 1.74 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 129.187 2.995 . . . . 0.0 113.491 -169.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.72 129.91 41.44 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.883 1.219 . . . . 0.0 111.55 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 79.7 p -117.56 127.35 53.89 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.731 1.212 . . . . 0.0 111.45 -178.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -140.92 146.75 37.83 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 121.585 0.707 . . . . 0.0 111.971 178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -78.13 -0.38 28.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.756 1.622 . . . . 0.0 114.5 -174.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.08 157.57 25.35 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.703 0.801 . . . . 0.0 111.406 169.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.75 160.57 46.11 Favored Pre-proline 0 CA--C 1.548 0.869 0 C-N-CA 126.759 2.024 . . . . 0.0 110.17 -170.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.457 ' HG3' HD11 ' A' ' 2' ' ' LEU . 37.3 Cg_exo -51.47 -52.47 8.96 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 123.785 2.99 . . . . 0.0 113.388 174.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 t -93.26 -161.64 0.86 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 129.578 3.151 . . . . 0.0 110.885 171.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.347 0 C-N-CA 130.125 3.726 . . . . 0.0 116.957 175.498 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.3 tttt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -66.29 146.08 99.01 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-N 119.699 1.136 . . . . 0.0 111.017 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -80.79 172.35 13.32 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.976 2.451 . . . . 0.0 112.29 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_exo -47.1 140.15 14.41 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 124.238 3.292 . . . . 0.0 115.313 178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.98 -16.08 56.31 Favored Glycine 0 CA--C 1.529 0.93 0 CA-C-O 118.129 -1.373 . . . . 0.0 115.169 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -81.4 104.88 12.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.715 1.757 . . . . 0.0 110.615 175.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -133.89 149.93 51.34 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -170.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.538 ' H ' ' HE3' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -53.21 128.15 26.96 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.533 1.933 . . . . 0.0 115.989 -169.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -146.18 173.25 12.39 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.949 2.5 . . . . 0.0 111.055 -171.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.68 140.06 17.71 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.263 1.025 . . . . 0.0 111.795 -171.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.407 ' CD1' ' H5 ' ' A' ' 101' ' ' NAG . 52.8 m-85 -85.82 156.28 20.64 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.372 1.469 . . . . 0.0 110.824 173.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.92 -14.49 47.41 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -178.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 55.4 p30 -86.37 -0.55 56.18 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.958 1.303 . . . . 0.0 113.38 171.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 94.29 14.14 52.0 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.688 1.137 . . . . 0.0 114.961 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 31.1 m -94.84 118.3 31.55 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.469 1.634 . . . . 0.0 109.231 -171.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 20.5 t -94.6 141.75 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 CA-C-O 121.672 0.749 . . . . 0.0 110.214 -172.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -152.26 179.76 8.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.353 1.461 . . . . 0.0 110.361 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.403 ' CE1' ' HB3' ' A' ' 30' ' ' ARG . 14.8 m-85 -112.77 136.49 52.33 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 125.879 1.672 . . . . 0.0 110.426 171.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -123.44 124.52 43.08 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.591 1.556 . . . . 0.0 109.865 -169.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -75.96 97.95 4.13 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 122.918 0.487 . . . . 0.0 111.058 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -66.7 -4.86 9.91 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -178.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 48.4 mt -91.98 -20.46 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.805 0 C-N-CA 124.476 1.11 . . . . 0.0 110.588 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 67.2 p -136.23 -21.8 1.37 Allowed 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.882 1.438 . . . . 0.0 114.882 -171.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 79.59 7.73 1.78 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 128.488 2.715 . . . . 0.0 113.52 -169.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -63.03 159.48 17.07 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 119.646 1.112 . . . . 0.0 111.361 171.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 85.1 p -149.84 150.0 31.31 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.939 -1.101 . . . . 0.0 112.672 -177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -150.93 128.6 11.54 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.853 1.661 . . . . 0.0 109.785 -172.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -67.39 -33.5 75.33 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.33 152.22 38.53 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.306 1.051 . . . . 0.0 113.009 178.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.403 ' HB3' ' CE1' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -130.01 160.62 64.33 Favored Pre-proline 0 CA--C 1.542 0.635 0 C-N-CA 126.679 1.992 . . . . 0.0 113.643 -169.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -49.97 160.58 1.25 Allowed 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 124.028 3.152 . . . . 0.0 116.455 -179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.9 p 167.4 78.57 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 130.374 3.47 . . . . 0.0 106.196 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 117.767 -1.574 . . . . 0.0 111.079 -169.339 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' NAG . . . . . 0.407 ' H5 ' ' CD1' ' A' ' 11' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_