data_2kbu_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 2kbu _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.0 m95 . . . . . 0 CA--C 1.532 0.287 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -136.8 157.09 47.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.834 2.053 . . . . 0.0 110.362 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.16 140.45 29.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.642 0.777 . . . . 0.0 111.628 169.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -132.39 161.13 34.39 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.324 2.25 . . . . 0.0 110.797 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.43 138.2 43.04 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.74 1.616 . . . . 0.0 112.74 -178.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 CA--C 1.534 0.365 0 C-N-CA 125.97 1.708 . . . . 0.0 108.531 173.52 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpt85 . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 121.177 0.513 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.05 143.21 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 124.976 1.31 . . . . 0.0 108.776 169.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -134.89 173.6 11.53 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.215 1.406 . . . . 0.0 110.79 171.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -121.3 137.1 54.84 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.639 1.175 . . . . 0.0 109.701 -176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.38 147.36 43.32 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.308 1.043 . . . . 0.0 112.387 -176.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -93.73 116.92 29.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.123 0.569 . . . . 0.0 111.142 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -68.29 -22.15 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.935 0.894 . . . . 0.0 112.519 -178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -95.89 -40.67 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.501 1.12 . . . . 0.0 111.254 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.87 -5.54 17.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.34 1.456 . . . . 0.0 113.467 -169.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.321 0.0 OUTLIER 59.79 -8.6 0.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.191 2.996 . . . . 0.0 118.103 -178.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.33 138.43 39.34 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.121 0.873 . . . . 0.0 111.758 173.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.1 p -140.2 128.47 22.5 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.763 1.225 . . . . 0.0 111.03 -170.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -152.77 151.95 31.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.023 0.929 . . . . 0.0 112.39 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.868 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.7 m95 . . . . . 0 C--O 1.228 -0.05 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -141.48 166.41 24.83 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 127.962 2.505 . . . . 0.0 108.589 169.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -133.41 151.74 51.84 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.139 -0.976 . . . . 0.0 112.995 170.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 mmp_? -134.52 158.71 43.25 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.075 2.55 . . . . 0.0 110.858 -169.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.16 151.02 40.13 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.864 1.266 . . . . 0.0 112.605 174.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 126.048 1.739 . . . . 0.0 109.339 174.601 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 CA-C-O 121.692 0.758 . . . . 0.0 112.284 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -140.86 149.12 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 127.055 2.142 . . . . 0.0 108.107 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -143.04 162.04 36.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.644 0.778 . . . . 0.0 112.473 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -97.05 135.22 39.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.254 1.421 . . . . 0.0 111.097 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.06 140.9 51.95 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.505 1.522 . . . . 0.0 111.18 172.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.44 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 14.7 t-20 -100.04 111.91 24.2 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.282 -169.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.64 -16.25 61.71 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.799 0.839 . . . . 0.0 111.912 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.5 mm -99.89 -45.35 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.425 1.09 . . . . 0.0 111.894 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.44 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 18.5 p -99.02 -8.65 25.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -174.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.316 0.0 OUTLIER 61.59 2.24 0.67 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.864 2.065 . . . . 0.0 115.615 -170.186 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.38 171.13 5.15 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 122.69 1.233 . . . . 0.0 112.54 174.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.9 m -155.98 148.39 23.69 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.667 -1.27 . . . . 0.0 111.227 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -157.75 150.66 23.04 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.173 0.989 . . . . 0.0 111.488 -173.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 123.054 0.542 . . . . 0.0 111.86 174.411 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.78 157.99 42.71 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 130.334 3.454 . . . . 0.0 109.433 172.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -119.0 125.39 49.27 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.542 -0.724 . . . . 0.0 112.132 -169.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.43 162.11 27.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.891 1.276 . . . . 0.0 113.307 -169.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.3 mtt -119.77 152.1 37.77 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.803 1.241 . . . . 0.0 111.581 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 127.016 2.126 . . . . 0.0 109.769 179.145 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? . . . . . 0 N--CA 1.468 0.442 0 CA-C-O 121.28 0.562 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -129.62 144.83 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 126.476 1.91 . . . . 0.0 108.686 174.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.2 p90 -148.7 168.32 23.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.126 0.97 . . . . 0.0 111.452 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -118.76 146.86 44.45 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.833 0.825 . . . . 0.0 109.532 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.31 153.17 51.24 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.076 -1.015 . . . . 0.0 110.101 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.601 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 34.5 t-20 -97.02 116.21 28.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.518 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -73.91 0.13 14.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.1 mt -113.91 -61.73 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.601 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 21.0 p -81.62 -4.9 57.37 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -175.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 20.2 m-80 60.23 3.05 0.49 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.148 2.579 . . . . 0.0 117.886 169.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.01 106.38 4.87 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.145 -0.972 . . . . 0.0 111.879 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.0 p -80.06 127.58 32.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.548 1.539 . . . . 0.0 111.013 169.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -159.9 162.87 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -169.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.179 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 31.8 m95 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.45 161.15 39.15 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.689 1.995 . . . . 0.0 111.271 171.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.449 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -90.86 156.18 18.21 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.584 1.328 . . . . 0.0 114.584 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -143.68 168.22 20.42 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.957 2.103 . . . . 0.0 109.669 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.5 mtt -121.8 152.25 39.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.048 0.939 . . . . 0.0 111.197 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.471 0.614 0 C-N-CA 124.5 1.12 . . . . 0.0 112.001 -175.814 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.252 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.97 148.31 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.445 1.898 . . . . 0.0 109.794 173.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -142.69 172.0 13.29 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.672 1.189 . . . . 0.0 110.891 170.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -123.11 142.19 51.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.074 0.95 . . . . 0.0 111.423 -169.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.88 141.98 50.34 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.656 1.182 . . . . 0.0 111.87 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -82.63 119.26 24.05 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.298 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . 0.252 1.4 p80 -84.55 23.86 1.08 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.982 1.265 . . . . 0.0 113.297 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.1 mt -126.76 -50.48 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 126.278 1.831 . . . . 0.0 109.788 172.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 m -92.42 -10.11 39.18 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.429 1.892 . . . . 0.0 112.816 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.272 68.8 m-20 57.6 -11.32 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.851 3.261 . . . . 0.0 117.921 -177.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.31 161.32 1.9 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 111.446 169.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -152.73 150.43 29.41 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.657 -1.277 . . . . 0.0 113.058 -169.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -165.29 -174.57 3.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.372 1.469 . . . . 0.0 110.568 177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 176.86 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -144.2 163.55 33.31 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 129.96 3.304 . . . . 0.0 109.293 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -115.31 151.87 33.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.2 1.0 . . . . 0.0 110.993 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -147.72 162.66 38.74 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.089 1.756 . . . . 0.0 111.509 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 97.5 mmm -116.92 147.79 41.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.66 1.184 . . . . 0.0 111.313 -178.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 CA--C 1.543 0.699 0 C-N-CA 126.49 1.916 . . . . 0.0 109.832 178.55 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 . . . . . 0 N--CA 1.467 0.381 0 CA-C-O 121.403 0.62 . . . . 0.0 112.637 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.3 p -121.56 144.8 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.831 2.052 . . . . 0.0 108.898 169.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -146.05 167.38 23.5 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.573 1.149 . . . . 0.0 111.375 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -114.21 146.94 39.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.663 0.785 . . . . 0.0 109.839 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.27 153.54 51.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.678 1.591 . . . . 0.0 110.758 176.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.554 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 30.9 t-20 -109.05 121.35 44.95 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -69.67 -23.01 63.4 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 112.999 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.3 mt -97.41 -59.62 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.32 1.448 . . . . 0.0 110.217 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.554 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 30.6 p -79.1 -11.1 59.98 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -176.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.351 49.5 m-80 52.81 40.54 30.8 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.897 2.079 . . . . 0.0 115.219 170.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.25 168.4 11.65 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.403 1.881 . . . . 0.0 109.357 169.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 162.06 36.42 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.436 1.095 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.07 161.89 12.84 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.935 1.294 . . . . 0.0 111.429 170.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.308 1.043 . . . . 0.0 112.845 177.601 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 22.8 m95 . . . . . 0 C--O 1.235 0.324 0 CA-C-O 121.782 0.801 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -106.99 150.59 26.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.628 1.571 . . . . 0.0 111.31 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.9 115.2 25.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.788 2.035 . . . . 0.0 107.437 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -134.29 163.0 30.63 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.691 1.196 . . . . 0.0 112.947 -169.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.14 147.68 51.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.771 1.228 . . . . 0.0 112.522 172.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.542 0.657 0 C-N-CA 126.972 2.109 . . . . 0.0 109.154 176.137 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 121.63 0.729 . . . . 0.0 112.342 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.5 t -116.97 150.53 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 127.177 2.191 . . . . 0.0 107.662 169.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -142.74 166.69 23.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 122.359 1.076 . . . . 0.0 113.293 173.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -120.19 131.99 55.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.511 2.325 . . . . 0.0 108.834 -176.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.26 139.53 46.98 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.454 1.101 . . . . 0.0 112.784 176.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -86.24 123.53 31.61 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.936 0.494 . . . . 0.0 111.351 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.21 2.99 22.16 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -114.68 -49.54 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.482 1.513 . . . . 0.0 110.143 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 m -93.31 -15.81 25.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.439 1.496 . . . . 0.0 113.013 -174.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 58.88 20.11 7.73 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.645 1.578 . . . . 0.0 114.532 -173.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.8 152.76 44.21 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.381 -0.824 . . . . 0.0 109.717 169.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.0 p -146.31 132.48 19.4 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.296 0.638 . . . . 0.0 112.152 -175.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -155.41 161.55 40.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.301 1.44 . . . . 0.0 110.834 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -170.577 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 m95 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -134.85 133.69 39.98 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.925 2.09 . . . . 0.0 107.695 168.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 130.23 38.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -137.8 163.65 30.86 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.016 -169.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.6 ptm -74.34 146.57 42.97 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.613 0.765 . . . . 0.0 112.585 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 CA--C 1.541 0.626 0 C-N-CA 126.427 1.891 . . . . 0.0 109.898 179.22 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 121.82 0.819 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.0 p -122.48 147.71 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 126.507 1.923 . . . . 0.0 107.644 169.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -141.55 171.21 14.37 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.098 0.959 . . . . 0.0 112.105 -178.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -116.27 130.21 56.67 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.07 1.748 . . . . 0.0 109.909 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.19 144.71 50.31 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.694 0.759 . . . . 0.0 111.542 169.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -88.91 118.85 28.92 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.87 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.47 -22.81 64.54 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.536 -1.353 . . . . 0.0 112.878 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 39.1 mm -94.85 -56.53 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.312 1.045 . . . . 0.0 110.641 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 m -74.77 -19.31 60.26 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.602 1.561 . . . . 0.0 111.908 -176.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.355 17.1 m-80 59.76 5.02 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 128.434 2.694 . . . . 0.0 116.317 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.96 155.2 40.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.89 1.276 . . . . 0.0 111.191 169.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.5 m -130.73 138.44 49.98 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.451 1.5 . . . . 0.0 110.758 -173.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.09 166.82 31.52 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.396 1.078 . . . . 0.0 112.059 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.401 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.4 m95 . . . . . 0 CA--C 1.532 0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -135.4 151.78 50.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.873 2.069 . . . . 0.0 110.754 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -97.3 136.37 37.89 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.85 1.26 . . . . 0.0 109.879 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -133.3 165.79 24.0 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.813 2.445 . . . . 0.0 109.952 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 15.8 mmt -121.67 142.14 50.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.632 0.73 . . . . 0.0 112.402 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 p . . . . . 0 CA--C 1.534 0.364 0 C-N-CA 127.355 2.262 . . . . 0.0 108.362 176.407 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 . . . . . 0 N--CA 1.471 0.584 0 CA-C-O 120.531 0.205 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.73 144.56 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.313 1.045 . . . . 0.0 111.022 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -135.72 166.33 23.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.321 0.582 . . . . 0.0 111.011 169.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -128.38 138.72 52.48 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.927 1.291 . . . . 0.0 109.551 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -135.03 148.73 49.99 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.164 0.986 . . . . 0.0 111.175 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -96.16 117.4 30.65 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.873 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -67.42 -15.76 63.85 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.46 -0.775 . . . . 0.0 112.424 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.34 -43.13 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.74 0.816 . . . . 0.0 111.849 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.4 p -123.51 -1.57 8.54 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -173.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.83 6.62 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.399 1.879 . . . . 0.0 115.134 -172.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.99 126.31 20.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.202 -0.936 . . . . 0.0 108.568 169.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 m -139.5 136.03 34.12 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.512 0.725 . . . . 0.0 111.41 -169.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -161.08 163.91 31.13 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.573 1.149 . . . . 0.0 111.676 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 . . . . . 0 N--CA 1.468 0.473 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -177.935 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 41.8 m95 . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.23 29.83 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.744 3.618 . . . . 0.0 106.622 169.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.09 126.23 36.11 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 111.503 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -136.6 166.46 23.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.713 1.205 . . . . 0.0 111.51 -173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -112.51 140.49 47.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.79 0.836 . . . . 0.0 111.165 -174.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 C--O 1.239 0.519 0 C-N-CA 126.544 1.938 . . . . 0.0 108.752 -176.268 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -101.16 141.99 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.507 1.523 . . . . 0.0 107.838 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -136.97 169.62 17.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.525 1.53 . . . . 0.0 111.492 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -110.49 128.13 55.48 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.416 0.687 . . . . 0.0 110.29 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -112.74 143.98 43.04 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.883 0.873 . . . . 0.0 109.651 169.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.766 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 38.0 t-20 -88.19 116.85 26.68 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 122.276 -0.265 . . . . 0.0 110.594 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -77.49 0.46 22.68 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.6 mt -117.22 -48.84 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.527 1.931 . . . . 0.0 110.287 176.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.766 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 0.2 OUTLIER -96.87 -5.36 38.38 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.698 1.599 . . . . 0.0 113.5 -172.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.299 0.2 OUTLIER 52.86 19.44 1.31 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.866 2.066 . . . . 0.0 116.325 -174.174 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.36 173.48 6.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.983 1.313 . . . . 0.0 112.112 171.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 m -153.1 135.69 15.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 111.209 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -145.58 147.04 31.65 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.506 1.122 . . . . 0.0 113.586 -169.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 . . . . . 0 CA--C 1.541 0.598 0 C-N-CA 124.99 1.316 . . . . 0.0 112.088 169.605 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 123.054 1.407 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.88 170.92 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.821 2.449 . . . . 0.0 112.144 -169.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.07 140.85 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.226 1.41 . . . . 0.0 112.856 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -141.58 169.73 17.05 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.842 2.057 . . . . 0.0 111.254 -169.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -120.99 145.23 47.97 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.46 1.104 . . . . 0.0 110.458 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 126.146 1.779 . . . . 0.0 111.428 -177.206 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.0 t -93.76 145.04 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.971 1.709 . . . . 0.0 109.356 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -137.36 167.79 20.91 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.902 1.281 . . . . 0.0 110.679 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -129.65 139.93 51.28 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.578 0.751 . . . . 0.0 109.858 -175.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -145.24 151.16 37.94 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -170.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -78.94 120.73 23.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.825 1.65 . . . . 0.0 110.426 173.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -81.21 7.6 10.89 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.9 mt -124.15 -45.47 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 126.271 1.828 . . . . 0.0 110.18 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -105.14 -4.16 22.16 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.33 1.852 . . . . 0.0 112.978 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.296 0.2 OUTLIER 54.49 6.58 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.578 2.351 . . . . 0.0 117.245 -176.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.65 122.98 10.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.2 m -131.11 136.35 48.3 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.378 1.071 . . . . 0.0 110.791 -169.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -139.23 143.62 38.1 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.357 1.063 . . . . 0.0 113.299 -171.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 125.684 1.594 . . . . 0.0 110.517 169.347 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 55.8 m95 . . . . . 0 N--CA 1.467 0.407 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.21 155.98 44.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.984 2.114 . . . . 0.0 110.093 174.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.403 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -84.2 152.97 23.91 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.384 0.674 . . . . 0.0 111.221 169.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -144.0 168.2 20.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.26 2.224 . . . . 0.0 109.09 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 tpt -118.76 158.41 25.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.987 0.898 . . . . 0.0 111.993 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--N 1.331 -0.229 0 C-N-CA 124.925 1.29 . . . . 0.0 110.455 172.485 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.7 tpt85 . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.421 0.629 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 p -85.29 141.84 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.445 1.098 . . . . 0.0 108.914 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -134.53 169.65 16.95 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.311 1.044 . . . . 0.0 111.051 173.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -118.65 136.99 53.6 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.159 1.384 . . . . 0.0 110.815 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -137.53 144.96 42.39 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 123.813 0.845 . . . . 0.0 112.689 -173.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -85.24 116.71 23.75 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.151 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -83.36 20.0 1.41 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -124.53 -44.8 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 126.276 1.831 . . . . 0.0 110.243 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 m -104.22 -12.77 16.48 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.584 1.954 . . . . 0.0 113.167 -169.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.324 0.0 OUTLIER 61.02 -4.17 0.14 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 128.191 2.596 . . . . 0.0 116.984 -170.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -43.77 121.95 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.143 1.377 . . . . 0.0 109.626 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -130.13 135.44 48.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.407 1.083 . . . . 0.0 111.42 -169.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -157.45 156.76 32.71 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.197 1.399 . . . . 0.0 110.549 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 . . . . . 0 N--CA 1.474 0.732 0 O-C-N 120.53 -1.356 . . . . 0.0 114.064 -176.02 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 48.3 m95 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -137.01 152.25 49.9 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.513 1.525 . . . . 0.0 110.325 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -105.66 127.52 53.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.679 1.591 . . . . 0.0 107.981 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -141.71 170.26 16.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.005 0.922 . . . . 0.0 112.285 -169.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.6 tpt -107.11 156.76 18.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 0.0 111.403 172.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.7 p . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 126.283 1.833 . . . . 0.0 109.152 178.569 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 p -96.36 147.5 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 126.134 1.773 . . . . 0.0 108.957 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -140.75 163.87 31.73 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.633 0.73 . . . . 0.0 112.695 174.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -123.72 133.52 53.85 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.338 1.055 . . . . 0.0 110.208 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.88 146.54 42.86 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.008 -1.058 . . . . 0.0 111.298 177.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.36 121.81 24.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.736 174.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -77.77 -11.68 59.9 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.9 -46.32 11.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 125.505 1.522 . . . . 0.0 110.649 173.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.7 -8.01 26.87 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.299 1.04 . . . . 0.0 113.644 -169.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.298 0.0 OUTLIER 60.81 -12.33 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.338 3.055 . . . . 0.0 118.002 -176.623 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.97 111.46 0.56 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.492 1.117 . . . . 0.0 111.008 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 m -96.29 122.62 39.35 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 125.758 1.623 . . . . 0.0 108.792 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -151.74 168.19 25.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 -168.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 123.574 0.75 . . . . 0.0 112.945 173.621 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.97 157.53 34.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 129.971 3.309 . . . . 0.0 108.62 169.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.31 134.84 48.83 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.516 1.127 . . . . 0.0 112.405 -175.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -137.86 161.99 35.16 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.47 1.508 . . . . 0.0 111.902 -169.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.7 ptm -87.31 141.91 28.29 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.129 0.972 . . . . 0.0 112.967 -176.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.8 t . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 109.654 176.379 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 CA--C 1.537 0.447 0 CA-C-O 121.451 0.643 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -112.37 148.33 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.701 2.0 . . . . 0.0 108.209 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -136.28 169.6 17.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.24 1.016 . . . . 0.0 111.905 174.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.73 130.13 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.619 1.568 . . . . 0.0 110.391 -176.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.33 146.56 51.94 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.43 1.092 . . . . 0.0 111.177 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -87.92 116.82 26.36 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.089 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -77.18 -0.09 23.75 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.69 -45.2 7.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 125.775 1.63 . . . . 0.0 110.342 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.0 t -126.89 12.37 7.26 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 -171.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.293 0.0 OUTLIER 61.61 -10.2 0.07 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 128.78 2.832 . . . . 0.0 118.0 176.701 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.32 122.37 2.19 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.785 1.634 . . . . 0.0 110.473 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -128.93 135.05 48.5 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.358 1.063 . . . . 0.0 112.926 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -156.38 168.22 28.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.482 1.513 . . . . 0.0 111.039 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 . . . . . 0 N--CA 1.475 0.815 0 O-C-N 120.559 -1.338 . . . . 0.0 113.488 171.744 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 m95 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -146.42 156.33 43.22 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.39 1.876 . . . . 0.0 110.929 -177.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 143.3 29.64 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.912 1.285 . . . . 0.0 112.506 -178.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -144.39 168.06 20.98 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.022 1.329 . . . . 0.0 111.495 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -123.26 134.82 54.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.237 1.015 . . . . 0.0 111.044 -174.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 127.393 2.277 . . . . 0.0 110.173 178.238 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 120.418 0.151 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.72 142.99 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.257 1.023 . . . . 0.0 111.231 170.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -133.98 167.43 20.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.071 1.348 . . . . 0.0 111.379 170.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.18 140.29 53.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.863 1.265 . . . . 0.0 110.161 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.66 147.37 51.42 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 124.282 1.033 . . . . 0.0 111.997 -171.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.454 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 37.4 t-20 -86.98 120.94 28.77 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.055 0.942 . . . . 0.0 109.69 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -71.96 -9.86 58.96 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.23 1.012 . . . . 0.0 113.033 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mt -109.42 -62.4 2.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.127 1.371 . . . . 0.0 109.681 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.454 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 22.9 p -80.2 -8.67 59.55 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -171.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 60.14 1.06 0.32 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.917 2.087 . . . . 0.0 114.929 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.09 128.78 19.73 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.727 1.211 . . . . 0.0 109.318 169.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.9 m -133.53 132.36 40.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.871 0.869 . . . . 0.0 110.605 -169.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -151.64 152.11 32.39 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.61 1.164 . . . . 0.0 110.99 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -173.37 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 122.722 1.248 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -140.22 153.35 46.54 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.783 2.433 . . . . 0.0 109.587 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -100.79 144.42 29.78 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.263 1.025 . . . . 0.0 110.341 -176.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -142.81 166.38 24.79 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.399 1.88 . . . . 0.0 109.918 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -122.76 150.47 42.74 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.541 0.736 . . . . 0.0 111.718 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.467 0.383 0 C-N-CA 123.685 0.794 . . . . 0.0 111.474 173.026 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.0 ttt85 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -103.34 133.82 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.27 171.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -126.55 165.24 19.52 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.454 1.901 . . . . 0.0 111.813 -177.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -115.3 135.38 54.21 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.802 0.841 . . . . 0.0 111.355 -172.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.61 151.39 50.27 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.557 1.543 . . . . 0.0 110.829 174.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -103.46 116.48 32.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.834 0.854 . . . . 0.0 111.099 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -71.03 -16.65 62.62 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.48 -0.762 . . . . 0.0 112.873 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 52.5 mt -94.11 -44.21 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.453 1.101 . . . . 0.0 110.826 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 p -106.93 -6.96 17.23 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.32 0.2 OUTLIER 53.04 17.27 0.88 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.897 2.079 . . . . 0.0 116.083 -170.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.7 160.18 32.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.324 0.65 . . . . 0.0 110.515 169.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.8 p -145.44 157.11 44.07 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.649 0.78 . . . . 0.0 111.936 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -152.74 146.68 25.3 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.498 1.119 . . . . 0.0 111.066 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.595 0 C-N-CA 122.783 0.433 . . . . 0.0 110.629 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.1 tttp . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 118.05 -0.976 . . . . 0.0 108.533 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 48.8 mt -72.03 162.87 71.22 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 123.46 0.704 . . . . 0.0 111.556 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -53.54 136.91 65.38 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.436 2.757 . . . . 0.0 115.019 -169.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -86.23 -163.53 0.18 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 125.059 3.84 . . . . 0.0 112.164 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.13 27.79 29.98 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.044 0.83 . . . . 0.0 114.14 174.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.422 ' CE2' ' HG3' ' A' ' 29' ' ' PRO . 73.0 m95 -101.3 160.57 14.3 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -176.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -136.8 157.09 47.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.834 2.053 . . . . 0.0 110.362 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.16 140.45 29.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.642 0.777 . . . . 0.0 111.628 169.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -132.39 161.13 34.39 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.324 2.25 . . . . 0.0 110.797 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.43 138.2 43.04 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.74 1.616 . . . . 0.0 112.74 -178.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 88.2 p -137.64 87.01 2.23 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.97 1.708 . . . . 0.0 108.531 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpt85 -111.25 143.23 42.36 Favored 'General case' 0 N--CA 1.47 0.551 1 CA-C-N 68.331 -22.213 . . . . 0.0 111.631 169.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.05 143.21 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 124.976 1.31 . . . . 0.0 108.776 169.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -134.89 173.6 11.53 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.215 1.406 . . . . 0.0 110.79 171.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -121.3 137.1 54.84 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.639 1.175 . . . . 0.0 109.701 -176.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.38 147.36 43.32 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.308 1.043 . . . . 0.0 112.387 -176.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -93.73 116.92 29.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.123 0.569 . . . . 0.0 111.142 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -68.29 -22.15 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.935 0.894 . . . . 0.0 112.519 -178.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -95.89 -40.67 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.501 1.12 . . . . 0.0 111.254 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.87 -5.54 17.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.34 1.456 . . . . 0.0 113.467 -169.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.321 0.0 OUTLIER 59.79 -8.6 0.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.191 2.996 . . . . 0.0 118.103 -178.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.33 138.43 39.34 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.121 0.873 . . . . 0.0 111.758 173.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.1 p -140.2 128.47 22.5 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.763 1.225 . . . . 0.0 111.03 -170.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -152.77 151.95 31.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.023 0.929 . . . . 0.0 112.39 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -73.11 -24.29 60.6 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -116.42 144.21 44.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.609 1.563 . . . . 0.0 110.08 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 ptm85 -83.66 150.21 59.01 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -174.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.422 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 27.9 Cg_endo -72.97 -166.91 0.32 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.212 3.275 . . . . 0.0 109.284 168.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.53 0.15 18.29 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 120.77 -1.206 . . . . 0.0 112.065 168.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.306 0 C-N-CA 128.578 2.99 . . . . 0.0 112.635 176.057 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.67 -32.63 13.78 Favored Pre-proline 0 CA--C 1.55 0.944 0 CA-C-O 117.193 -1.384 . . . . 0.0 114.112 173.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -52.98 163.85 1.91 Allowed 'Trans proline' 0 CA--C 1.55 1.324 0 C-N-CA 123.171 2.581 . . . . 0.0 115.543 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -52.32 161.25 2.81 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 125.088 3.859 . . . . 0.0 117.313 -169.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -1.22 20.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.054 1.311 . . . . 0.0 113.885 -171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -102.6 157.45 16.92 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 124.541 1.136 . . . . 0.0 114.039 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -141.48 166.41 24.83 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 127.962 2.505 . . . . 0.0 108.589 169.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -133.41 151.74 51.84 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.139 -0.976 . . . . 0.0 112.995 170.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 mmp_? -134.52 158.71 43.25 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.075 2.55 . . . . 0.0 110.858 -169.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.16 151.02 40.13 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.864 1.266 . . . . 0.0 112.605 174.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -140.3 53.48 1.64 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.048 1.739 . . . . 0.0 109.339 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.68 179.45 5.68 Favored 'General case' 0 CA--C 1.539 0.525 1 CA-C-N 63.723 -24.308 . . . . 0.0 112.284 169.869 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -140.86 149.12 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 127.055 2.142 . . . . 0.0 108.107 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -143.04 162.04 36.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.644 0.778 . . . . 0.0 112.473 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -97.05 135.22 39.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.254 1.421 . . . . 0.0 111.097 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.06 140.9 51.95 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.505 1.522 . . . . 0.0 111.18 172.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.44 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 14.7 t-20 -100.04 111.91 24.2 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.282 -169.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.64 -16.25 61.71 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.799 0.839 . . . . 0.0 111.912 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.5 mm -99.89 -45.35 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.425 1.09 . . . . 0.0 111.894 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.44 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 18.5 p -99.02 -8.65 25.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -174.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.316 0.0 OUTLIER 61.59 2.24 0.67 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.864 2.065 . . . . 0.0 115.615 -170.186 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.38 171.13 5.15 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 122.69 1.233 . . . . 0.0 112.54 174.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.9 m -155.98 148.39 23.69 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.667 -1.27 . . . . 0.0 111.227 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -157.75 150.66 23.04 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.173 0.989 . . . . 0.0 111.488 -173.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -83.83 -36.04 23.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.054 0.542 . . . . 0.0 111.86 174.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -74.21 168.89 18.69 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.413 0.685 . . . . 0.0 109.645 169.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.09 134.23 32.03 Favored Pre-proline 0 CA--C 1.546 0.808 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -169.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . 0.286 18.1 Cg_exo 25.62 61.43 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 2 C-N-CA 126.904 5.069 . . . . 0.0 123.431 168.548 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.8 m -78.9 -35.1 44.11 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 168.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.484 0 C-N-CA 126.327 1.918 . . . . 0.0 112.888 169.236 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.3 pttm . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.061 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.67 172.41 6.65 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 125.506 1.522 . . . . 0.0 111.318 -177.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -58.61 176.13 0.47 Allowed 'Trans proline' 0 CA--C 1.551 1.335 0 C-N-CA 124.836 3.69 . . . . 0.0 115.078 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -59.81 177.82 0.44 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.872 3.715 . . . . 0.0 116.333 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.52 37.45 4.26 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.515 1.055 . . . . 0.0 113.852 -178.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -82.02 168.15 18.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.78 157.99 42.71 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 130.334 3.454 . . . . 0.0 109.433 172.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -119.0 125.39 49.27 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.542 -0.724 . . . . 0.0 112.132 -169.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.43 162.11 27.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.891 1.276 . . . . 0.0 113.307 -169.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.3 mtt -119.77 152.1 37.77 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.803 1.241 . . . . 0.0 111.581 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.2 t -131.54 45.74 2.75 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.016 2.126 . . . . 0.0 109.769 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -127.15 160.73 30.33 Favored 'General case' 0 N--CA 1.468 0.442 1 CA-C-N 64.023 -24.171 . . . . 0.0 111.843 169.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -129.62 144.83 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 126.476 1.91 . . . . 0.0 108.686 174.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.2 p90 -148.7 168.32 23.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.126 0.97 . . . . 0.0 111.452 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -118.76 146.86 44.45 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.833 0.825 . . . . 0.0 109.532 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.31 153.17 51.24 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.076 -1.015 . . . . 0.0 110.101 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.601 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 34.5 t-20 -97.02 116.21 28.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.518 179.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -73.91 0.13 14.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.1 mt -113.91 -61.73 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.601 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 21.0 p -81.62 -4.9 57.37 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -175.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 20.2 m-80 60.23 3.05 0.49 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.148 2.579 . . . . 0.0 117.886 169.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.01 106.38 4.87 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.145 -0.972 . . . . 0.0 111.879 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.0 p -80.06 127.58 32.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.548 1.539 . . . . 0.0 111.013 169.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -159.9 162.87 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -169.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -87.35 -21.41 25.7 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -75.88 116.63 16.77 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.313 0.96 . . . . 0.0 110.94 172.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -113.67 145.61 33.76 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 125.504 1.522 . . . . 0.0 113.203 -170.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -72.54 -170.84 0.64 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.972 3.781 . . . . 0.0 112.634 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 76.9 p -75.0 57.17 0.79 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.506 1.522 . . . . 0.0 112.937 172.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.046 1.308 . . . . 0.0 113.089 174.93 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.7 mttp . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 87.2 mt -142.9 174.83 3.29 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 128.311 2.644 . . . . 0.0 107.451 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -57.07 163.86 7.2 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 122.556 2.171 . . . . 0.0 113.116 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.53 178.44 0.93 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.918 3.079 . . . . 0.0 115.069 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.75 71.94 1.28 Allowed Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.309 0.956 . . . . 0.0 112.697 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -126.55 166.87 16.48 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.186 1.395 . . . . 0.0 112.42 -174.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.45 161.15 39.15 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.689 1.995 . . . . 0.0 111.271 171.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.449 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -90.86 156.18 18.21 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.584 1.328 . . . . 0.0 114.584 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -143.68 168.22 20.42 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.957 2.103 . . . . 0.0 109.669 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.5 mtt -121.8 152.25 39.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.048 0.939 . . . . 0.0 111.197 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.1 t -135.34 40.16 2.85 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.5 1.12 . . . . 0.0 112.001 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -120.82 151.2 39.9 Favored 'General case' 0 C--O 1.234 0.252 1 CA-C-N 67.581 -22.554 . . . . 0.0 113.298 168.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.97 148.31 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.445 1.898 . . . . 0.0 109.794 173.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -142.69 172.0 13.29 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.672 1.189 . . . . 0.0 110.891 170.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -123.11 142.19 51.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.074 0.95 . . . . 0.0 111.423 -169.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.88 141.98 50.34 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.656 1.182 . . . . 0.0 111.87 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -82.63 119.26 24.05 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.298 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . 0.252 1.4 p80 -84.55 23.86 1.08 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.982 1.265 . . . . 0.0 113.297 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.1 mt -126.76 -50.48 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 126.278 1.831 . . . . 0.0 109.788 172.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 m -92.42 -10.11 39.18 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.429 1.892 . . . . 0.0 112.816 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.272 68.8 m-20 57.6 -11.32 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.851 3.261 . . . . 0.0 117.921 -177.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.31 161.32 1.9 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 111.446 169.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -152.73 150.43 29.41 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.657 -1.277 . . . . 0.0 113.058 -169.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -165.29 -174.57 3.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.372 1.469 . . . . 0.0 110.568 177.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -88.38 -16.25 33.45 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 176.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -73.23 154.32 40.28 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 175.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttt180 -122.97 125.33 26.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.429 1.491 . . . . 0.0 110.548 170.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -74.06 -165.06 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.972 3.115 . . . . 0.0 111.804 169.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.2 p -72.81 64.26 0.66 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.342 1.057 . . . . 0.0 110.252 169.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.324 0 C-N-CA 126.137 1.827 . . . . 0.0 112.039 -174.396 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.0 ptpp? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 94.4 mt -148.96 166.34 15.55 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 126.987 2.115 . . . . 0.0 109.705 -169.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.76 172.98 0.29 Allowed 'Trans proline' 0 CA--C 1.55 1.32 0 C-N-CA 124.915 3.743 . . . . 0.0 114.912 174.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -57.51 179.56 0.13 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 125.014 3.809 . . . . 0.0 117.101 -173.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.1 12.81 38.43 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.77 1.176 . . . . 0.0 114.225 -174.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.0 154.73 37.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -170.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -144.2 163.55 33.31 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 129.96 3.304 . . . . 0.0 109.293 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -115.31 151.87 33.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.2 1.0 . . . . 0.0 110.993 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -147.72 162.66 38.74 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.089 1.756 . . . . 0.0 111.509 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 97.5 mmm -116.92 147.79 41.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.66 1.184 . . . . 0.0 111.313 -178.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t -128.62 45.15 2.83 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.49 1.916 . . . . 0.0 109.832 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -119.43 160.64 21.94 Favored 'General case' 0 N--CA 1.467 0.381 1 CA-C-N 64.551 -23.931 . . . . 0.0 112.637 169.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.3 p -121.56 144.8 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.831 2.052 . . . . 0.0 108.898 169.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -146.05 167.38 23.5 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.573 1.149 . . . . 0.0 111.375 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -114.21 146.94 39.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.663 0.785 . . . . 0.0 109.839 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.27 153.54 51.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.678 1.591 . . . . 0.0 110.758 176.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.554 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 30.9 t-20 -109.05 121.35 44.95 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -69.67 -23.01 63.4 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 112.999 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.3 mt -97.41 -59.62 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.32 1.448 . . . . 0.0 110.217 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.554 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 30.6 p -79.1 -11.1 59.98 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -176.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.351 49.5 m-80 52.81 40.54 30.8 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.897 2.079 . . . . 0.0 115.219 170.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.25 168.4 11.65 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.403 1.881 . . . . 0.0 109.357 169.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 162.06 36.42 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.436 1.095 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.07 161.89 12.84 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.935 1.294 . . . . 0.0 111.429 170.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -82.26 -21.84 36.05 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.308 1.043 . . . . 0.0 112.845 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.62 144.99 26.39 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.047 0.939 . . . . 0.0 109.746 171.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.9 ptt85 -109.23 148.98 39.1 Favored Pre-proline 0 CA--C 1.543 0.679 0 N-CA-C 115.958 1.836 . . . . 0.0 115.958 -168.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.98 48.55 0.5 Allowed 'Trans proline' 0 CA--C 1.548 1.219 1 C-N-CA 126.021 4.481 . . . . 0.0 113.099 170.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.4 p 59.4 -17.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 118.872 2.915 . . . . 0.0 118.872 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.073 0 C-N-CA 126.053 1.787 . . . . 0.0 114.604 169.914 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.9 mttp . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 116.828 -1.558 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.7 tp -129.33 94.86 31.97 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 120.735 1.607 . . . . 0.0 112.481 -169.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -64.56 -28.52 61.4 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.099 3.2 . . . . 0.0 116.523 171.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_exo -66.21 153.66 77.2 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.627 2.885 . . . . 0.0 113.828 169.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.07 7.95 72.96 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 123.911 0.767 . . . . 0.0 114.555 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 22.8 m95 -122.71 152.57 40.44 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.511 1.125 . . . . 0.0 112.462 -178.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -106.99 150.59 26.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.628 1.571 . . . . 0.0 111.31 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.9 115.2 25.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.788 2.035 . . . . 0.0 107.437 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -134.29 163.0 30.63 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.691 1.196 . . . . 0.0 112.947 -169.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.14 147.68 51.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.771 1.228 . . . . 0.0 112.522 172.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.4 t -137.07 51.83 1.95 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.972 2.109 . . . . 0.0 109.154 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.21 175.55 8.83 Favored 'General case' 0 CA--C 1.537 0.446 1 CA-C-N 64.161 -24.108 . . . . 0.0 112.342 169.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.5 t -116.97 150.53 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 127.177 2.191 . . . . 0.0 107.662 169.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -142.74 166.69 23.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 122.359 1.076 . . . . 0.0 113.293 173.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -120.19 131.99 55.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.511 2.325 . . . . 0.0 108.834 -176.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.26 139.53 46.98 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.454 1.101 . . . . 0.0 112.784 176.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -86.24 123.53 31.61 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.936 0.494 . . . . 0.0 111.351 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.21 2.99 22.16 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -114.68 -49.54 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.482 1.513 . . . . 0.0 110.143 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 m -93.31 -15.81 25.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.439 1.496 . . . . 0.0 113.013 -174.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 58.88 20.11 7.73 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.645 1.578 . . . . 0.0 114.532 -173.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.8 152.76 44.21 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.381 -0.824 . . . . 0.0 109.717 169.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.0 p -146.31 132.48 19.4 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.296 0.638 . . . . 0.0 112.152 -175.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -155.41 161.55 40.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.301 1.44 . . . . 0.0 110.834 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -72.42 -36.61 68.66 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -170.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.84 176.53 5.08 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.414 1.085 . . . . 0.0 109.106 171.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -59.09 158.13 19.05 Favored Pre-proline 0 N--CA 1.474 0.763 0 C-N-CA 125.048 1.339 . . . . 0.0 111.653 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -73.75 60.53 4.41 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.265 2.643 . . . . 0.0 110.783 169.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -60.43 -38.61 84.65 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 111.871 -174.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 C-N-CA 125.686 1.612 . . . . 0.0 112.127 179.26 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.1 pttm . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 118.744 -0.646 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 55.6 mt -146.9 179.36 1.18 Allowed Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 126.066 1.746 . . . . 0.0 111.335 -169.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.71 178.9 0.6 Allowed 'Trans proline' 0 CA--C 1.554 1.509 0 C-N-CA 124.356 3.371 . . . . 0.0 115.253 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -64.58 -177.35 0.52 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.832 3.688 . . . . 0.0 116.485 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.49 88.61 0.55 Allowed Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.205 1.859 . . . . 0.0 113.21 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -136.93 161.48 35.92 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 -169.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -134.85 133.69 39.98 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.925 2.09 . . . . 0.0 107.695 168.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 130.23 38.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -137.8 163.65 30.86 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.016 -169.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.6 ptm -74.34 146.57 42.97 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.613 0.765 . . . . 0.0 112.585 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 t -132.92 44.82 2.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.427 1.891 . . . . 0.0 109.898 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 -121.81 172.83 7.88 Favored 'General case' 0 N--CA 1.469 0.481 1 CA-C-N 63.71 -24.314 . . . . 0.0 111.602 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.0 p -122.48 147.71 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 126.507 1.923 . . . . 0.0 107.644 169.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -141.55 171.21 14.37 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.098 0.959 . . . . 0.0 112.105 -178.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -116.27 130.21 56.67 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.07 1.748 . . . . 0.0 109.909 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.19 144.71 50.31 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.694 0.759 . . . . 0.0 111.542 169.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -88.91 118.85 28.92 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.87 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.47 -22.81 64.54 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.536 -1.353 . . . . 0.0 112.878 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 39.1 mm -94.85 -56.53 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.312 1.045 . . . . 0.0 110.641 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 m -74.77 -19.31 60.26 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.602 1.561 . . . . 0.0 111.908 -176.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.355 17.1 m-80 59.76 5.02 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 128.434 2.694 . . . . 0.0 116.317 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.96 155.2 40.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.89 1.276 . . . . 0.0 111.191 169.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.5 m -130.73 138.44 49.98 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.451 1.5 . . . . 0.0 110.758 -173.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.09 166.82 31.52 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.396 1.078 . . . . 0.0 112.059 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -95.64 -15.64 22.59 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -74.26 175.28 7.74 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.85 0.833 . . . . 0.0 112.193 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 mtm105 -94.49 179.58 1.18 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.17 1.388 . . . . 0.0 109.55 168.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -54.18 172.64 0.28 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.734 2.956 . . . . 0.0 112.764 168.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -71.19 37.78 0.05 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.509 1.523 . . . . 0.0 114.101 177.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.08 0 C-N-CA 127.884 2.659 . . . . 0.0 109.839 -178.171 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 pttp . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 119.612 -0.233 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 50.0 tp -116.97 -32.78 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 125.855 1.662 . . . . 0.0 114.135 173.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -64.04 172.06 6.66 Favored 'Trans proline' 0 CA--C 1.55 1.294 0 C-N-CA 122.896 2.397 . . . . 0.0 114.662 176.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -63.77 -169.75 0.11 Allowed 'Trans proline' 0 CA--C 1.545 1.061 1 C-N-CA 125.806 4.338 . . . . 0.0 117.138 -176.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.55 -103.82 2.98 Favored Glycine 0 C--N 1.342 0.896 0 N-CA-C 107.419 -2.273 . . . . 0.0 107.419 -169.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -71.04 153.06 42.91 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.655 0.727 . . . . 0.0 110.641 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -135.4 151.78 50.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.873 2.069 . . . . 0.0 110.754 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -97.3 136.37 37.89 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.85 1.26 . . . . 0.0 109.879 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -133.3 165.79 24.0 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.813 2.445 . . . . 0.0 109.952 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 15.8 mmt -121.67 142.14 50.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.632 0.73 . . . . 0.0 112.402 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 p -130.53 73.07 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.355 2.262 . . . . 0.0 108.362 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -113.8 125.22 53.84 Favored 'General case' 0 N--CA 1.471 0.584 1 CA-C-N 67.096 -22.775 . . . . 0.0 110.492 169.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.73 144.56 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.313 1.045 . . . . 0.0 111.022 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -135.72 166.33 23.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.321 0.582 . . . . 0.0 111.011 169.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -128.38 138.72 52.48 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.927 1.291 . . . . 0.0 109.551 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -135.03 148.73 49.99 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.164 0.986 . . . . 0.0 111.175 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -96.16 117.4 30.65 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.873 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -67.42 -15.76 63.85 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.46 -0.775 . . . . 0.0 112.424 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.34 -43.13 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.74 0.816 . . . . 0.0 111.849 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.4 p -123.51 -1.57 8.54 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -173.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.83 6.62 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.399 1.879 . . . . 0.0 115.134 -172.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.99 126.31 20.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.202 -0.936 . . . . 0.0 108.568 169.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 m -139.5 136.03 34.12 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.512 0.725 . . . . 0.0 111.41 -169.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -161.08 163.91 31.13 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.573 1.149 . . . . 0.0 111.676 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -73.26 -49.65 26.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.77 168.83 17.62 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 174.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -111.43 162.28 21.67 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 -167.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.94 -142.82 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.126 1 C-N-CA 125.655 4.237 . . . . 0.0 107.671 167.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.2 t -64.38 48.15 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 126.264 1.825 . . . . 0.0 115.443 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.237 0 C-N-CA 127.149 2.309 . . . . 0.0 115.509 170.357 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -72.45 160.27 83.21 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 123.941 0.896 . . . . 0.0 112.227 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -64.66 154.18 73.66 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.589 2.859 . . . . 0.0 114.939 -171.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -65.32 174.61 4.91 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.747 3.631 . . . . 0.0 116.368 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.56 41.59 1.02 Allowed Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.597 1.57 . . . . 0.0 111.994 -171.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -78.44 170.82 16.03 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -168.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.23 29.83 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.744 3.618 . . . . 0.0 106.622 169.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.09 126.23 36.11 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 111.503 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -136.6 166.46 23.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.713 1.205 . . . . 0.0 111.51 -173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -112.51 140.49 47.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.79 0.836 . . . . 0.0 111.165 -174.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.5 p -138.33 89.15 2.36 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.544 1.938 . . . . 0.0 108.752 -176.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.67 162.72 18.53 Favored 'General case' 0 N--CA 1.472 0.667 1 CA-C-N 69.635 -21.62 . . . . 0.0 113.852 169.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -101.16 141.99 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.507 1.523 . . . . 0.0 107.838 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -136.97 169.62 17.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.525 1.53 . . . . 0.0 111.492 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -110.49 128.13 55.48 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.416 0.687 . . . . 0.0 110.29 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -112.74 143.98 43.04 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.883 0.873 . . . . 0.0 109.651 169.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.766 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 38.0 t-20 -88.19 116.85 26.68 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 122.276 -0.265 . . . . 0.0 110.594 -175.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -77.49 0.46 22.68 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.6 mt -117.22 -48.84 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.527 1.931 . . . . 0.0 110.287 176.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.766 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 0.2 OUTLIER -96.87 -5.36 38.38 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.698 1.599 . . . . 0.0 113.5 -172.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.299 0.2 OUTLIER 52.86 19.44 1.31 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.866 2.066 . . . . 0.0 116.325 -174.174 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.36 173.48 6.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.983 1.313 . . . . 0.0 112.112 171.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 m -153.1 135.69 15.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 111.209 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -145.58 147.04 31.65 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.506 1.122 . . . . 0.0 113.586 -169.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.85 -14.99 25.49 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.99 1.316 . . . . 0.0 112.088 169.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -82.58 -5.22 58.66 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.947 1.699 . . . . 0.0 115.342 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.27 0.0 OUTLIER 34.46 63.46 1.87 Allowed Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 128.256 2.622 . . . . 0.0 113.145 -170.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.96 127.11 21.33 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 123.367 2.711 . . . . 0.0 115.737 -169.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.0 t 48.01 6.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 120.368 3.47 . . . . 0.0 120.368 169.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.972 0 CA-C-O 118.097 -1.391 . . . . 0.0 111.45 172.057 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.93 152.27 84.54 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.404 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -52.9 -33.85 63.56 Favored 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 123.894 3.063 . . . . 0.0 119.757 -169.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -47.02 151.97 2.05 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 123.991 3.127 . . . . 0.0 115.876 -170.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.07 -15.2 3.34 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -168.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -117.2 172.64 7.16 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.691 2.245 . . . . 0.0 113.837 -177.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.88 170.92 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.821 2.449 . . . . 0.0 112.144 -169.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.07 140.85 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.226 1.41 . . . . 0.0 112.856 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -141.58 169.73 17.05 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.842 2.057 . . . . 0.0 111.254 -169.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -120.99 145.23 47.97 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.46 1.104 . . . . 0.0 110.458 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.9 t -126.57 38.18 4.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.146 1.779 . . . . 0.0 111.428 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -138.17 157.82 45.53 Favored 'General case' 0 N--CA 1.467 0.402 1 CA-C-N 68.67 -22.059 . . . . 0.0 113.62 169.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.0 t -93.76 145.04 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.971 1.709 . . . . 0.0 109.356 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -137.36 167.79 20.91 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.902 1.281 . . . . 0.0 110.679 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -129.65 139.93 51.28 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.578 0.751 . . . . 0.0 109.858 -175.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -145.24 151.16 37.94 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -170.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -78.94 120.73 23.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.825 1.65 . . . . 0.0 110.426 173.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -81.21 7.6 10.89 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.9 mt -124.15 -45.47 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 126.271 1.828 . . . . 0.0 110.18 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -105.14 -4.16 22.16 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.33 1.852 . . . . 0.0 112.978 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.296 0.2 OUTLIER 54.49 6.58 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.578 2.351 . . . . 0.0 117.245 -176.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.65 122.98 10.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.2 m -131.11 136.35 48.3 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.378 1.071 . . . . 0.0 110.791 -169.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -139.23 143.62 38.1 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.357 1.063 . . . . 0.0 113.299 -171.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -101.34 -14.19 17.71 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.684 1.594 . . . . 0.0 110.517 169.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.92 -6.05 58.2 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 127.894 2.477 . . . . 0.0 114.127 173.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.358 0.0 OUTLIER 60.81 151.27 0.1 OUTLIER Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 131.105 3.762 . . . . 0.0 114.009 -169.446 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -22.94 141.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.965 1 C-N-CA 130.284 7.323 . . . . 0.0 118.958 -172.048 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.4 p -55.55 87.63 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.817 2.047 . . . . 0.0 113.255 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 C-N-CA 130.074 3.702 . . . . 0.0 106.894 -174.044 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.435 ' H2 ' ' C ' ' A' ' 31' ' ' GLY . 36.1 mtmm . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.169 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 34.4 mt -83.06 160.92 59.31 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.268 1.027 . . . . 0.0 110.796 169.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.13 156.71 65.1 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.303 2.669 . . . . 0.0 113.362 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -79.04 170.49 17.76 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.242 3.294 . . . . 0.0 112.419 175.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.14 87.28 0.26 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.435 1.017 . . . . 0.0 114.197 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -122.12 163.51 19.37 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.285 1.034 . . . . 0.0 113.456 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.21 155.98 44.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.984 2.114 . . . . 0.0 110.093 174.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.403 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -84.2 152.97 23.91 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.384 0.674 . . . . 0.0 111.221 169.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -144.0 168.2 20.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.26 2.224 . . . . 0.0 109.09 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 tpt -118.76 158.41 25.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.987 0.898 . . . . 0.0 111.993 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.2 m -160.18 110.95 1.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.925 1.29 . . . . 0.0 110.455 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.7 tpt85 -107.96 139.06 43.15 Favored 'General case' 0 N--CA 1.469 0.497 1 CA-C-N 69.683 -21.599 . . . . 0.0 112.579 174.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 p -85.29 141.84 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.445 1.098 . . . . 0.0 108.914 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -134.53 169.65 16.95 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.311 1.044 . . . . 0.0 111.051 173.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -118.65 136.99 53.6 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.159 1.384 . . . . 0.0 110.815 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -137.53 144.96 42.39 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 123.813 0.845 . . . . 0.0 112.689 -173.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -85.24 116.71 23.75 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.151 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -83.36 20.0 1.41 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -124.53 -44.8 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 126.276 1.831 . . . . 0.0 110.243 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 m -104.22 -12.77 16.48 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.584 1.954 . . . . 0.0 113.167 -169.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.324 0.0 OUTLIER 61.02 -4.17 0.14 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 128.191 2.596 . . . . 0.0 116.984 -170.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -43.77 121.95 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.143 1.377 . . . . 0.0 109.626 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -130.13 135.44 48.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.407 1.083 . . . . 0.0 111.42 -169.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -157.45 156.76 32.71 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.197 1.399 . . . . 0.0 110.549 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -66.71 -32.22 73.39 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.53 -1.356 . . . . 0.0 114.064 -176.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -120.99 174.17 6.79 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.79 1.236 . . . . 0.0 112.29 -179.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.7 mtm-85 -69.7 156.12 92.28 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.788 1.235 . . . . 0.0 112.412 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -56.27 149.19 56.48 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.277 2.652 . . . . 0.0 113.199 170.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.4 p -78.56 18.75 0.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.74 1.616 . . . . 0.0 114.176 173.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . 0.435 ' C ' ' H2 ' ' A' ' 1' ' ' LYS . . . . . . . . 0 C--O 1.248 1.014 0 C-N-CA 126.238 1.875 . . . . 0.0 112.416 -171.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.131 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 17.0 mt -154.88 163.25 25.06 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.787 1.635 . . . . 0.0 111.11 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -56.51 168.4 2.21 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.805 3.67 . . . . 0.0 115.376 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -54.8 162.73 4.67 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.708 3.605 . . . . 0.0 115.989 -175.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.64 95.42 1.12 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -169.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 48.3 m95 -144.41 166.7 24.35 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.454 1.501 . . . . 0.0 111.113 -173.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -137.01 152.25 49.9 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.513 1.525 . . . . 0.0 110.325 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -105.66 127.52 53.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.679 1.591 . . . . 0.0 107.981 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -141.71 170.26 16.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.005 0.922 . . . . 0.0 112.285 -169.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.6 tpt -107.11 156.76 18.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 0.0 111.403 172.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.7 p -147.73 84.51 1.54 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.283 1.833 . . . . 0.0 109.152 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.6 164.62 22.47 Favored 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 68.208 -22.269 . . . . 0.0 113.114 172.822 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 p -96.36 147.5 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 126.134 1.773 . . . . 0.0 108.957 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -140.75 163.87 31.73 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.633 0.73 . . . . 0.0 112.695 174.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -123.72 133.52 53.85 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.338 1.055 . . . . 0.0 110.208 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.88 146.54 42.86 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.008 -1.058 . . . . 0.0 111.298 177.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.36 121.81 24.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.736 174.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -77.77 -11.68 59.9 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.9 -46.32 11.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 125.505 1.522 . . . . 0.0 110.649 173.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.7 -8.01 26.87 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.299 1.04 . . . . 0.0 113.644 -169.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.298 0.0 OUTLIER 60.81 -12.33 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.338 3.055 . . . . 0.0 118.002 -176.623 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.97 111.46 0.56 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.492 1.117 . . . . 0.0 111.008 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 m -96.29 122.62 39.35 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 125.758 1.623 . . . . 0.0 108.792 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -151.74 168.19 25.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 -168.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -92.0 -17.22 25.4 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.574 0.75 . . . . 0.0 112.945 173.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -69.96 151.39 45.66 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.056 0.389 . . . . 0.0 110.114 169.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.1 mtm105 -138.57 151.29 68.65 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.064 -169.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -78.1 -170.8 1.04 Allowed 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 123.96 3.107 . . . . 0.0 109.657 169.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 90.5 p -70.63 72.16 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.708 1.203 . . . . 0.0 112.296 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.75 1.643 . . . . 0.0 112.075 177.585 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.6 mttm . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.65 160.69 81.58 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -70.85 159.58 52.14 Favored 'Trans proline' 0 CA--C 1.546 1.102 0 C-N-CA 123.963 3.109 . . . . 0.0 115.238 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.55 163.78 33.52 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 124.906 3.737 . . . . 0.0 114.849 -176.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.05 50.89 0.66 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.595 1.569 . . . . 0.0 111.174 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -83.66 165.06 19.28 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 -169.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.97 157.53 34.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 129.971 3.309 . . . . 0.0 108.62 169.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.31 134.84 48.83 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.516 1.127 . . . . 0.0 112.405 -175.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -137.86 161.99 35.16 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.47 1.508 . . . . 0.0 111.902 -169.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.7 ptm -87.31 141.91 28.29 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.129 0.972 . . . . 0.0 112.967 -176.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.8 t -129.46 46.56 2.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 109.654 176.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -130.4 168.09 17.53 Favored 'General case' 0 CA--C 1.537 0.447 1 CA-C-N 64.323 -24.035 . . . . 0.0 111.82 169.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -112.37 148.33 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.701 2.0 . . . . 0.0 108.209 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -136.28 169.6 17.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.24 1.016 . . . . 0.0 111.905 174.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.73 130.13 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.619 1.568 . . . . 0.0 110.391 -176.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.33 146.56 51.94 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.43 1.092 . . . . 0.0 111.177 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -87.92 116.82 26.36 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.089 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -77.18 -0.09 23.75 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.69 -45.2 7.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 125.775 1.63 . . . . 0.0 110.342 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.0 t -126.89 12.37 7.26 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 -171.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.293 0.0 OUTLIER 61.61 -10.2 0.07 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 128.78 2.832 . . . . 0.0 118.0 176.701 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.32 122.37 2.19 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.785 1.634 . . . . 0.0 110.473 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -128.93 135.05 48.5 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.358 1.063 . . . . 0.0 112.926 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -156.38 168.22 28.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.482 1.513 . . . . 0.0 111.039 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -80.18 -14.37 58.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.559 -1.338 . . . . 0.0 113.488 171.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -96.84 158.7 15.31 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -171.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.34 149.89 36.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.121 1.368 . . . . 0.0 109.648 168.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -59.97 110.19 0.72 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.654 2.902 . . . . 0.0 111.961 -174.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -158.92 46.84 0.31 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.869 1.668 . . . . 0.0 110.077 -170.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 CA-C-O 117.619 -1.656 . . . . 0.0 110.17 -169.649 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.6 tt -146.95 111.93 4.14 Favored Pre-proline 0 CA--C 1.544 0.736 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -80.98 148.87 17.41 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.661 2.24 . . . . 0.0 112.686 -174.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -69.83 167.88 23.24 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.323 2.682 . . . . 0.0 112.274 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.64 65.8 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-O 119.014 -0.881 . . . . 0.0 114.933 176.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -122.07 162.43 21.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.746 1.273 . . . . 0.0 112.849 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -146.42 156.33 43.22 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.39 1.876 . . . . 0.0 110.929 -177.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 143.3 29.64 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.912 1.285 . . . . 0.0 112.506 -178.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -144.39 168.06 20.98 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.022 1.329 . . . . 0.0 111.495 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -123.26 134.82 54.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.237 1.015 . . . . 0.0 111.044 -174.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.0 t -113.61 42.97 1.87 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.393 2.277 . . . . 0.0 110.173 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.26 135.14 54.46 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 66.558 -23.019 . . . . 0.0 111.317 169.849 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.72 142.99 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.257 1.023 . . . . 0.0 111.231 170.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -133.98 167.43 20.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.071 1.348 . . . . 0.0 111.379 170.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.18 140.29 53.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.863 1.265 . . . . 0.0 110.161 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.66 147.37 51.42 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 124.282 1.033 . . . . 0.0 111.997 -171.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.454 ' ND2' ' HG1' ' A' ' 21' ' ' THR . 37.4 t-20 -86.98 120.94 28.77 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.055 0.942 . . . . 0.0 109.69 179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -71.96 -9.86 58.96 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.23 1.012 . . . . 0.0 113.033 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mt -109.42 -62.4 2.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.127 1.371 . . . . 0.0 109.681 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.454 ' HG1' ' ND2' ' A' ' 18' ' ' ASN . 22.9 p -80.2 -8.67 59.55 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -171.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 60.14 1.06 0.32 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.917 2.087 . . . . 0.0 114.929 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.09 128.78 19.73 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.727 1.211 . . . . 0.0 109.318 169.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.9 m -133.53 132.36 40.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.871 0.869 . . . . 0.0 110.605 -169.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -151.64 152.11 32.39 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.61 1.164 . . . . 0.0 110.99 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -66.11 -40.28 90.61 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -173.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -108.38 145.61 34.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.083 177.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -69.63 158.1 87.87 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -56.69 138.37 84.84 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.239 1.959 . . . . 0.0 109.858 168.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 85.9 p -90.43 -0.4 57.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -172.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.142 0 C-N-CA 126.684 2.087 . . . . 0.0 114.65 -170.839 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.9 mmtm . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -85.48 -31.29 0.44 Allowed Pre-proline 0 CA--C 1.549 0.913 0 CA-C-O 116.584 -1.675 . . . . 0.0 114.797 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -60.16 -22.43 70.03 Favored 'Trans proline' 0 CA--C 1.55 1.285 0 N-CA-C 118.87 2.604 . . . . 0.0 118.87 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -59.52 161.93 16.24 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.564 2.176 . . . . 0.0 113.386 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -69.34 68.49 0.52 Allowed Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.656 1.122 . . . . 0.0 113.651 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -75.04 156.72 35.87 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.722 1.248 . . . . 0.0 112.917 174.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -140.22 153.35 46.54 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.783 2.433 . . . . 0.0 109.587 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -100.79 144.42 29.78 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.263 1.025 . . . . 0.0 110.341 -176.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -142.81 166.38 24.79 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.399 1.88 . . . . 0.0 109.918 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -122.76 150.47 42.74 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.541 0.736 . . . . 0.0 111.718 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.2 m -159.65 125.05 4.13 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.685 0.794 . . . . 0.0 111.474 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.0 ttt85 -117.98 154.95 31.11 Favored 'General case' 0 N--CA 1.472 0.646 1 CA-C-N 68.864 -21.971 . . . . 0.0 113.246 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -103.34 133.82 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.27 171.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -126.55 165.24 19.52 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.454 1.901 . . . . 0.0 111.813 -177.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -115.3 135.38 54.21 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.802 0.841 . . . . 0.0 111.355 -172.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.61 151.39 50.27 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.557 1.543 . . . . 0.0 110.829 174.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -103.46 116.48 32.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.834 0.854 . . . . 0.0 111.099 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -71.03 -16.65 62.62 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.48 -0.762 . . . . 0.0 112.873 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 52.5 mt -94.11 -44.21 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.453 1.101 . . . . 0.0 110.826 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 p -106.93 -6.96 17.23 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.32 0.2 OUTLIER 53.04 17.27 0.88 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.897 2.079 . . . . 0.0 116.083 -170.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.7 160.18 32.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.324 0.65 . . . . 0.0 110.515 169.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.8 p -145.44 157.11 44.07 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.649 0.78 . . . . 0.0 111.936 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -152.74 146.68 25.3 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.498 1.119 . . . . 0.0 111.066 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -44.99 77.15 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.783 0.433 . . . . 0.0 110.629 -172.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -96.96 143.84 27.44 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.183 0.993 . . . . 0.0 110.541 169.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.501 ' H ' ' NE ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -61.24 153.2 69.11 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 125.218 1.407 . . . . 0.0 110.916 169.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -53.29 136.3 62.25 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 121.86 1.707 . . . . 0.0 112.965 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 p -78.36 -9.25 59.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.795 1.238 . . . . 0.0 113.828 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.139 0 C-N-CA 127.953 2.692 . . . . 0.0 110.052 179.304 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.0 m95 . . . . . 0 CA--C 1.532 0.287 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -136.8 157.09 47.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.834 2.053 . . . . 0.0 110.362 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.16 140.45 29.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.642 0.777 . . . . 0.0 111.628 169.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -132.39 161.13 34.39 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.324 2.25 . . . . 0.0 110.797 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.43 138.2 43.04 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.74 1.616 . . . . 0.0 112.74 -178.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 CA--C 1.534 0.365 0 C-N-CA 125.97 1.708 . . . . 0.0 108.531 173.52 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpt85 . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 121.177 0.513 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.05 143.21 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 124.976 1.31 . . . . 0.0 108.776 169.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -134.89 173.6 11.53 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.215 1.406 . . . . 0.0 110.79 171.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -121.3 137.1 54.84 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.639 1.175 . . . . 0.0 109.701 -176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.38 147.36 43.32 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.308 1.043 . . . . 0.0 112.387 -176.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -93.73 116.92 29.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.123 0.569 . . . . 0.0 111.142 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -68.29 -22.15 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.935 0.894 . . . . 0.0 112.519 -178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -95.89 -40.67 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.501 1.12 . . . . 0.0 111.254 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.87 -5.54 17.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.34 1.456 . . . . 0.0 113.467 -169.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.321 0.0 OUTLIER 59.79 -8.6 0.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.191 2.996 . . . . 0.0 118.103 -178.601 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.33 138.43 39.34 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.121 0.873 . . . . 0.0 111.758 173.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.1 p -140.2 128.47 22.5 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.763 1.225 . . . . 0.0 111.03 -170.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -152.77 151.95 31.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.023 0.929 . . . . 0.0 112.39 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.868 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.7 m95 . . . . . 0 C--O 1.228 -0.05 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -141.48 166.41 24.83 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 127.962 2.505 . . . . 0.0 108.589 169.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -133.41 151.74 51.84 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.139 -0.976 . . . . 0.0 112.995 170.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 mmp_? -134.52 158.71 43.25 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.075 2.55 . . . . 0.0 110.858 -169.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.16 151.02 40.13 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.864 1.266 . . . . 0.0 112.605 174.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 126.048 1.739 . . . . 0.0 109.339 174.601 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 CA-C-O 121.692 0.758 . . . . 0.0 112.284 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -140.86 149.12 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 127.055 2.142 . . . . 0.0 108.107 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -143.04 162.04 36.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.644 0.778 . . . . 0.0 112.473 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -97.05 135.22 39.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.254 1.421 . . . . 0.0 111.097 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.06 140.9 51.95 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.505 1.522 . . . . 0.0 111.18 172.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -100.04 111.91 24.2 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.282 -169.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.64 -16.25 61.71 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.799 0.839 . . . . 0.0 111.912 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.5 mm -99.89 -45.35 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.425 1.09 . . . . 0.0 111.894 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.5 p -99.02 -8.65 25.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -174.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.316 0.0 OUTLIER 61.59 2.24 0.67 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.864 2.065 . . . . 0.0 115.615 -170.186 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.38 171.13 5.15 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 122.69 1.233 . . . . 0.0 112.54 174.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.9 m -155.98 148.39 23.69 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.667 -1.27 . . . . 0.0 111.227 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -157.75 150.66 23.04 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.173 0.989 . . . . 0.0 111.488 -173.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 123.054 0.542 . . . . 0.0 111.86 174.411 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.78 157.99 42.71 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 130.334 3.454 . . . . 0.0 109.433 172.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -119.0 125.39 49.27 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.542 -0.724 . . . . 0.0 112.132 -169.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.43 162.11 27.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.891 1.276 . . . . 0.0 113.307 -169.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.3 mtt -119.77 152.1 37.77 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.803 1.241 . . . . 0.0 111.581 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 127.016 2.126 . . . . 0.0 109.769 179.145 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? . . . . . 0 N--CA 1.468 0.442 0 CA-C-O 121.28 0.562 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -129.62 144.83 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 126.476 1.91 . . . . 0.0 108.686 174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.2 p90 -148.7 168.32 23.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.126 0.97 . . . . 0.0 111.452 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -118.76 146.86 44.45 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.833 0.825 . . . . 0.0 109.532 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.31 153.17 51.24 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.076 -1.015 . . . . 0.0 110.101 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -97.02 116.21 28.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.518 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -73.91 0.13 14.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.1 mt -113.91 -61.73 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.0 p -81.62 -4.9 57.37 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -175.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 20.2 m-80 60.23 3.05 0.49 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.148 2.579 . . . . 0.0 117.886 169.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.01 106.38 4.87 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.145 -0.972 . . . . 0.0 111.879 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.0 p -80.06 127.58 32.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.548 1.539 . . . . 0.0 111.013 169.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -159.9 162.87 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -169.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.179 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 31.8 m95 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.45 161.15 39.15 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.689 1.995 . . . . 0.0 111.271 171.636 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.464 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -90.86 156.18 18.21 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.584 1.328 . . . . 0.0 114.584 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -143.68 168.22 20.42 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.957 2.103 . . . . 0.0 109.669 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.5 mtt -121.8 152.25 39.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.048 0.939 . . . . 0.0 111.197 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.471 0.614 0 C-N-CA 124.5 1.12 . . . . 0.0 112.001 -175.814 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.252 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.97 148.31 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.445 1.898 . . . . 0.0 109.794 173.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -142.69 172.0 13.29 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.672 1.189 . . . . 0.0 110.891 170.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -123.11 142.19 51.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.074 0.95 . . . . 0.0 111.423 -169.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.88 141.98 50.34 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.656 1.182 . . . . 0.0 111.87 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -82.63 119.26 24.05 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.298 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . 0.252 1.4 p80 -84.55 23.86 1.08 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.982 1.265 . . . . 0.0 113.297 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.1 mt -126.76 -50.48 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 126.278 1.831 . . . . 0.0 109.788 172.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 m -92.42 -10.11 39.18 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.429 1.892 . . . . 0.0 112.816 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.272 68.8 m-20 57.6 -11.32 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.851 3.261 . . . . 0.0 117.921 -177.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.31 161.32 1.9 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 111.446 169.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -152.73 150.43 29.41 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.657 -1.277 . . . . 0.0 113.058 -169.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -165.29 -174.57 3.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.372 1.469 . . . . 0.0 110.568 177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 176.86 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -144.2 163.55 33.31 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 129.96 3.304 . . . . 0.0 109.293 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -115.31 151.87 33.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.2 1.0 . . . . 0.0 110.993 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -147.72 162.66 38.74 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.089 1.756 . . . . 0.0 111.509 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 97.5 mmm -116.92 147.79 41.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.66 1.184 . . . . 0.0 111.313 -178.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 CA--C 1.543 0.699 0 C-N-CA 126.49 1.916 . . . . 0.0 109.832 178.55 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 . . . . . 0 N--CA 1.467 0.381 0 CA-C-O 121.403 0.62 . . . . 0.0 112.637 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.3 p -121.56 144.8 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.831 2.052 . . . . 0.0 108.898 169.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -146.05 167.38 23.5 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.573 1.149 . . . . 0.0 111.375 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -114.21 146.94 39.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.663 0.785 . . . . 0.0 109.839 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.27 153.54 51.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.678 1.591 . . . . 0.0 110.758 176.04 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -109.05 121.35 44.95 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -69.67 -23.01 63.4 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 112.999 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.3 mt -97.41 -59.62 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.32 1.448 . . . . 0.0 110.217 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.6 p -79.1 -11.1 59.98 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.351 49.5 m-80 52.81 40.54 30.8 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.897 2.079 . . . . 0.0 115.219 170.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.25 168.4 11.65 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.403 1.881 . . . . 0.0 109.357 169.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 162.06 36.42 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.436 1.095 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.07 161.89 12.84 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.935 1.294 . . . . 0.0 111.429 170.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.308 1.043 . . . . 0.0 112.845 177.601 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.421 ' HB2' ' CE2' ' A' ' 16' ' ' TYR . 22.8 m95 . . . . . 0 C--O 1.235 0.324 0 CA-C-O 121.782 0.801 . . . . 0.0 112.462 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -106.99 150.59 26.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.628 1.571 . . . . 0.0 111.31 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.9 115.2 25.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.788 2.035 . . . . 0.0 107.437 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -134.29 163.0 30.63 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.691 1.196 . . . . 0.0 112.947 -169.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.14 147.68 51.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.771 1.228 . . . . 0.0 112.522 172.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.542 0.657 0 C-N-CA 126.972 2.109 . . . . 0.0 109.154 176.137 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 121.63 0.729 . . . . 0.0 112.342 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.5 t -116.97 150.53 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 127.177 2.191 . . . . 0.0 107.662 169.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -142.74 166.69 23.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 122.359 1.076 . . . . 0.0 113.293 173.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.421 ' CE2' ' HB2' ' A' ' 6' ' ' TRP . 1.2 t80 -120.19 131.99 55.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.511 2.325 . . . . 0.0 108.834 -176.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.26 139.53 46.98 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.454 1.101 . . . . 0.0 112.784 176.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -86.24 123.53 31.61 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.936 0.494 . . . . 0.0 111.351 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.21 2.99 22.16 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -114.68 -49.54 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.482 1.513 . . . . 0.0 110.143 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 m -93.31 -15.81 25.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.439 1.496 . . . . 0.0 113.013 -174.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 58.88 20.11 7.73 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.645 1.578 . . . . 0.0 114.532 -173.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.8 152.76 44.21 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.381 -0.824 . . . . 0.0 109.717 169.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.0 p -146.31 132.48 19.4 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.296 0.638 . . . . 0.0 112.152 -175.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -155.41 161.55 40.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.301 1.44 . . . . 0.0 110.834 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -170.577 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 m95 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -134.85 133.69 39.98 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.925 2.09 . . . . 0.0 107.695 168.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 130.23 38.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -137.8 163.65 30.86 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.016 -169.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.6 ptm -74.34 146.57 42.97 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.613 0.765 . . . . 0.0 112.585 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 CA--C 1.541 0.626 0 C-N-CA 126.427 1.891 . . . . 0.0 109.898 179.22 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 121.82 0.819 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.0 p -122.48 147.71 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 126.507 1.923 . . . . 0.0 107.644 169.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -141.55 171.21 14.37 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.098 0.959 . . . . 0.0 112.105 -178.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -116.27 130.21 56.67 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.07 1.748 . . . . 0.0 109.909 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.19 144.71 50.31 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.694 0.759 . . . . 0.0 111.542 169.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -88.91 118.85 28.92 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.87 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.47 -22.81 64.54 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.536 -1.353 . . . . 0.0 112.878 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 39.1 mm -94.85 -56.53 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.312 1.045 . . . . 0.0 110.641 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 m -74.77 -19.31 60.26 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.602 1.561 . . . . 0.0 111.908 -176.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.355 17.1 m-80 59.76 5.02 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 128.434 2.694 . . . . 0.0 116.317 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.96 155.2 40.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.89 1.276 . . . . 0.0 111.191 169.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.5 m -130.73 138.44 49.98 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.451 1.5 . . . . 0.0 110.758 -173.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.09 166.82 31.52 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.396 1.078 . . . . 0.0 112.059 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.401 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.4 m95 . . . . . 0 CA--C 1.532 0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -135.4 151.78 50.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.873 2.069 . . . . 0.0 110.754 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -97.3 136.37 37.89 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.85 1.26 . . . . 0.0 109.879 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -133.3 165.79 24.0 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.813 2.445 . . . . 0.0 109.952 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 15.8 mmt -121.67 142.14 50.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.632 0.73 . . . . 0.0 112.402 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 p . . . . . 0 CA--C 1.534 0.364 0 C-N-CA 127.355 2.262 . . . . 0.0 108.362 176.407 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 . . . . . 0 N--CA 1.471 0.584 0 CA-C-O 120.531 0.205 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.73 144.56 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.313 1.045 . . . . 0.0 111.022 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -135.72 166.33 23.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.321 0.582 . . . . 0.0 111.011 169.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -128.38 138.72 52.48 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.927 1.291 . . . . 0.0 109.551 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -135.03 148.73 49.99 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.164 0.986 . . . . 0.0 111.175 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -96.16 117.4 30.65 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.873 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -67.42 -15.76 63.85 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.46 -0.775 . . . . 0.0 112.424 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.34 -43.13 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.74 0.816 . . . . 0.0 111.849 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.4 p -123.51 -1.57 8.54 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -173.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.83 6.62 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.399 1.879 . . . . 0.0 115.134 -172.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.99 126.31 20.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.202 -0.936 . . . . 0.0 108.568 169.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 m -139.5 136.03 34.12 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.512 0.725 . . . . 0.0 111.41 -169.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -161.08 163.91 31.13 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.573 1.149 . . . . 0.0 111.676 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 . . . . . 0 N--CA 1.468 0.473 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -177.935 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 41.8 m95 . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.23 29.83 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.744 3.618 . . . . 0.0 106.622 169.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.09 126.23 36.11 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 111.503 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -136.6 166.46 23.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.713 1.205 . . . . 0.0 111.51 -173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -112.51 140.49 47.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.79 0.836 . . . . 0.0 111.165 -174.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 C--O 1.239 0.519 0 C-N-CA 126.544 1.938 . . . . 0.0 108.752 -176.268 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -101.16 141.99 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.507 1.523 . . . . 0.0 107.838 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -136.97 169.62 17.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.525 1.53 . . . . 0.0 111.492 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -110.49 128.13 55.48 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.416 0.687 . . . . 0.0 110.29 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -112.74 143.98 43.04 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.883 0.873 . . . . 0.0 109.651 169.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -88.19 116.85 26.68 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 122.276 -0.265 . . . . 0.0 110.594 -175.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -77.49 0.46 22.68 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.6 mt -117.22 -48.84 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.527 1.931 . . . . 0.0 110.287 176.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.87 -5.36 38.38 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.698 1.599 . . . . 0.0 113.5 -172.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.299 0.2 OUTLIER 52.86 19.44 1.31 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.866 2.066 . . . . 0.0 116.325 -174.174 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.36 173.48 6.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.983 1.313 . . . . 0.0 112.112 171.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 m -153.1 135.69 15.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 111.209 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -145.58 147.04 31.65 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.506 1.122 . . . . 0.0 113.586 -169.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 . . . . . 0 CA--C 1.541 0.598 0 C-N-CA 124.99 1.316 . . . . 0.0 112.088 169.605 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.422 ' HE1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 t-105 . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 123.054 1.407 . . . . 0.0 113.837 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.88 170.92 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.821 2.449 . . . . 0.0 112.144 -169.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.07 140.85 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.226 1.41 . . . . 0.0 112.856 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -141.58 169.73 17.05 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.842 2.057 . . . . 0.0 111.254 -169.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -120.99 145.23 47.97 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.46 1.104 . . . . 0.0 110.458 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 126.146 1.779 . . . . 0.0 111.428 -177.206 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.0 t -93.76 145.04 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.971 1.709 . . . . 0.0 109.356 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -137.36 167.79 20.91 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.902 1.281 . . . . 0.0 110.679 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.422 ' HB3' ' HE1' ' A' ' 6' ' ' TRP . 27.2 m-85 -129.65 139.93 51.28 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.578 0.751 . . . . 0.0 109.858 -175.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -145.24 151.16 37.94 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -170.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -78.94 120.73 23.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.825 1.65 . . . . 0.0 110.426 173.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -81.21 7.6 10.89 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.9 mt -124.15 -45.47 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 126.271 1.828 . . . . 0.0 110.18 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -105.14 -4.16 22.16 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.33 1.852 . . . . 0.0 112.978 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.296 0.2 OUTLIER 54.49 6.58 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.578 2.351 . . . . 0.0 117.245 -176.769 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.65 122.98 10.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.2 m -131.11 136.35 48.3 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.378 1.071 . . . . 0.0 110.791 -169.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -139.23 143.62 38.1 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.357 1.063 . . . . 0.0 113.299 -171.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 125.684 1.594 . . . . 0.0 110.517 169.347 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 55.8 m95 . . . . . 0 N--CA 1.467 0.407 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.21 155.98 44.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.984 2.114 . . . . 0.0 110.093 174.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -84.2 152.97 23.91 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.384 0.674 . . . . 0.0 111.221 169.62 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -144.0 168.2 20.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.26 2.224 . . . . 0.0 109.09 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 tpt -118.76 158.41 25.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.987 0.898 . . . . 0.0 111.993 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--N 1.331 -0.229 0 C-N-CA 124.925 1.29 . . . . 0.0 110.455 172.485 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.7 tpt85 . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.421 0.629 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 p -85.29 141.84 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.445 1.098 . . . . 0.0 108.914 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -134.53 169.65 16.95 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.311 1.044 . . . . 0.0 111.051 173.46 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -118.65 136.99 53.6 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.159 1.384 . . . . 0.0 110.815 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -137.53 144.96 42.39 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 123.813 0.845 . . . . 0.0 112.689 -173.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -85.24 116.71 23.75 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.151 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -83.36 20.0 1.41 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -124.53 -44.8 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 126.276 1.831 . . . . 0.0 110.243 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 m -104.22 -12.77 16.48 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.584 1.954 . . . . 0.0 113.167 -169.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.324 0.0 OUTLIER 61.02 -4.17 0.14 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 128.191 2.596 . . . . 0.0 116.984 -170.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -43.77 121.95 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.143 1.377 . . . . 0.0 109.626 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -130.13 135.44 48.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.407 1.083 . . . . 0.0 111.42 -169.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -157.45 156.76 32.71 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.197 1.399 . . . . 0.0 110.549 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 . . . . . 0 N--CA 1.474 0.732 0 O-C-N 120.53 -1.356 . . . . 0.0 114.064 -176.02 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 48.3 m95 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -137.01 152.25 49.9 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.513 1.525 . . . . 0.0 110.325 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -105.66 127.52 53.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.679 1.591 . . . . 0.0 107.981 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -141.71 170.26 16.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.005 0.922 . . . . 0.0 112.285 -169.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.6 tpt -107.11 156.76 18.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 0.0 111.403 172.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.7 p . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 126.283 1.833 . . . . 0.0 109.152 178.569 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 p -96.36 147.5 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 126.134 1.773 . . . . 0.0 108.957 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -140.75 163.87 31.73 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.633 0.73 . . . . 0.0 112.695 174.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -123.72 133.52 53.85 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.338 1.055 . . . . 0.0 110.208 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.88 146.54 42.86 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.008 -1.058 . . . . 0.0 111.298 177.084 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.36 121.81 24.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.736 174.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -77.77 -11.68 59.9 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.9 -46.32 11.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 125.505 1.522 . . . . 0.0 110.649 173.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.7 -8.01 26.87 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.299 1.04 . . . . 0.0 113.644 -169.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.298 0.0 OUTLIER 60.81 -12.33 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.338 3.055 . . . . 0.0 118.002 -176.623 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.97 111.46 0.56 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.492 1.117 . . . . 0.0 111.008 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 m -96.29 122.62 39.35 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 125.758 1.623 . . . . 0.0 108.792 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -151.74 168.19 25.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 -168.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 123.574 0.75 . . . . 0.0 112.945 173.621 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.97 157.53 34.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 129.971 3.309 . . . . 0.0 108.62 169.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.31 134.84 48.83 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.516 1.127 . . . . 0.0 112.405 -175.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -137.86 161.99 35.16 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.47 1.508 . . . . 0.0 111.902 -169.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.7 ptm -87.31 141.91 28.29 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.129 0.972 . . . . 0.0 112.967 -176.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.8 t . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 109.654 176.379 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 CA--C 1.537 0.447 0 CA-C-O 121.451 0.643 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -112.37 148.33 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.701 2.0 . . . . 0.0 108.209 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -136.28 169.6 17.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.24 1.016 . . . . 0.0 111.905 174.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.73 130.13 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.619 1.568 . . . . 0.0 110.391 -176.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.33 146.56 51.94 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.43 1.092 . . . . 0.0 111.177 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -87.92 116.82 26.36 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.089 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -77.18 -0.09 23.75 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.69 -45.2 7.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 125.775 1.63 . . . . 0.0 110.342 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.0 t -126.89 12.37 7.26 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 -171.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.293 0.0 OUTLIER 61.61 -10.2 0.07 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 128.78 2.832 . . . . 0.0 118.0 176.701 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.32 122.37 2.19 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.785 1.634 . . . . 0.0 110.473 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -128.93 135.05 48.5 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.358 1.063 . . . . 0.0 112.926 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -156.38 168.22 28.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.482 1.513 . . . . 0.0 111.039 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 . . . . . 0 N--CA 1.475 0.815 0 O-C-N 120.559 -1.338 . . . . 0.0 113.488 171.744 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 m95 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -146.42 156.33 43.22 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.39 1.876 . . . . 0.0 110.929 -177.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 143.3 29.64 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.912 1.285 . . . . 0.0 112.506 -178.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -144.39 168.06 20.98 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.022 1.329 . . . . 0.0 111.495 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -123.26 134.82 54.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.237 1.015 . . . . 0.0 111.044 -174.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 127.393 2.277 . . . . 0.0 110.173 178.238 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 120.418 0.151 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.72 142.99 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.257 1.023 . . . . 0.0 111.231 170.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -133.98 167.43 20.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.071 1.348 . . . . 0.0 111.379 170.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.18 140.29 53.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.863 1.265 . . . . 0.0 110.161 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.66 147.37 51.42 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 124.282 1.033 . . . . 0.0 111.997 -171.199 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -86.98 120.94 28.77 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.055 0.942 . . . . 0.0 109.69 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -71.96 -9.86 58.96 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.23 1.012 . . . . 0.0 113.033 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mt -109.42 -62.4 2.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.127 1.371 . . . . 0.0 109.681 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.9 p -80.2 -8.67 59.55 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -171.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 60.14 1.06 0.32 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.917 2.087 . . . . 0.0 114.929 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.09 128.78 19.73 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.727 1.211 . . . . 0.0 109.318 169.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.9 m -133.53 132.36 40.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.871 0.869 . . . . 0.0 110.605 -169.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -151.64 152.11 32.39 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.61 1.164 . . . . 0.0 110.99 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -173.37 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 122.722 1.248 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -140.22 153.35 46.54 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.783 2.433 . . . . 0.0 109.587 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -100.79 144.42 29.78 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.263 1.025 . . . . 0.0 110.341 -176.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -142.81 166.38 24.79 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.399 1.88 . . . . 0.0 109.918 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -122.76 150.47 42.74 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.541 0.736 . . . . 0.0 111.718 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.467 0.383 0 C-N-CA 123.685 0.794 . . . . 0.0 111.474 173.026 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.0 ttt85 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -103.34 133.82 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.27 171.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -126.55 165.24 19.52 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.454 1.901 . . . . 0.0 111.813 -177.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -115.3 135.38 54.21 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.802 0.841 . . . . 0.0 111.355 -172.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.61 151.39 50.27 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.557 1.543 . . . . 0.0 110.829 174.046 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -103.46 116.48 32.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.834 0.854 . . . . 0.0 111.099 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -71.03 -16.65 62.62 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.48 -0.762 . . . . 0.0 112.873 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 52.5 mt -94.11 -44.21 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.453 1.101 . . . . 0.0 110.826 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 p -106.93 -6.96 17.23 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.32 0.2 OUTLIER 53.04 17.27 0.88 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.897 2.079 . . . . 0.0 116.083 -170.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.7 160.18 32.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.324 0.65 . . . . 0.0 110.515 169.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.8 p -145.44 157.11 44.07 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.649 0.78 . . . . 0.0 111.936 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -152.74 146.68 25.3 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.498 1.119 . . . . 0.0 111.066 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.595 0 C-N-CA 122.783 0.433 . . . . 0.0 110.629 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.1 tttp . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 118.05 -0.976 . . . . 0.0 108.533 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.452 HD12 ' H ' ' A' ' 30' ' ' SER . 48.8 mt -72.03 162.87 71.22 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 123.46 0.704 . . . . 0.0 111.556 172.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -53.54 136.91 65.38 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.436 2.757 . . . . 0.0 115.019 -169.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -86.23 -163.53 0.18 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 125.059 3.84 . . . . 0.0 112.164 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.13 27.79 29.98 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.044 0.83 . . . . 0.0 114.14 174.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.453 ' CE2' ' HG3' ' A' ' 29' ' ' PRO . 73.0 m95 -101.3 160.57 14.3 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -176.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -136.8 157.09 47.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.834 2.053 . . . . 0.0 110.362 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.16 140.45 29.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.642 0.777 . . . . 0.0 111.628 169.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -132.39 161.13 34.39 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.324 2.25 . . . . 0.0 110.797 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.43 138.2 43.04 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.74 1.616 . . . . 0.0 112.74 -178.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 88.2 p -137.64 87.01 2.23 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.97 1.708 . . . . 0.0 108.531 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpt85 -111.25 143.23 42.36 Favored 'General case' 0 N--CA 1.47 0.551 1 CA-C-N 68.331 -22.213 . . . . 0.0 111.631 169.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.05 143.21 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 124.976 1.31 . . . . 0.0 108.776 169.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -134.89 173.6 11.53 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.215 1.406 . . . . 0.0 110.79 171.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -121.3 137.1 54.84 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.639 1.175 . . . . 0.0 109.701 -176.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.38 147.36 43.32 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.308 1.043 . . . . 0.0 112.387 -176.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -93.73 116.92 29.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.123 0.569 . . . . 0.0 111.142 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -68.29 -22.15 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.935 0.894 . . . . 0.0 112.519 -178.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -95.89 -40.67 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.501 1.12 . . . . 0.0 111.254 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.87 -5.54 17.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.34 1.456 . . . . 0.0 113.467 -169.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.321 0.0 OUTLIER 59.79 -8.6 0.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.191 2.996 . . . . 0.0 118.103 -178.601 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.33 138.43 39.34 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.121 0.873 . . . . 0.0 111.758 173.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.1 p -140.2 128.47 22.5 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.763 1.225 . . . . 0.0 111.03 -170.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -152.77 151.95 31.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.023 0.929 . . . . 0.0 112.39 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -73.11 -24.29 60.6 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -116.42 144.21 44.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.609 1.563 . . . . 0.0 110.08 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 ptm85 -83.66 150.21 59.01 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -174.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.453 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 27.9 Cg_endo -72.97 -166.91 0.32 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.212 3.275 . . . . 0.0 109.284 168.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.452 ' H ' HD12 ' A' ' 2' ' ' LEU . 0.0 OUTLIER -75.53 0.15 18.29 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 120.77 -1.206 . . . . 0.0 112.065 168.757 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.306 0 C-N-CA 128.578 2.99 . . . . 0.0 112.635 176.057 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.67 -32.63 13.78 Favored Pre-proline 0 CA--C 1.55 0.944 0 CA-C-O 117.193 -1.384 . . . . 0.0 114.112 173.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -52.98 163.85 1.91 Allowed 'Trans proline' 0 CA--C 1.55 1.324 0 C-N-CA 123.171 2.581 . . . . 0.0 115.543 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -52.32 161.25 2.81 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 125.088 3.859 . . . . 0.0 117.313 -169.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -1.22 20.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.054 1.311 . . . . 0.0 113.885 -171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -102.6 157.45 16.92 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 124.541 1.136 . . . . 0.0 114.039 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -141.48 166.41 24.83 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 127.962 2.505 . . . . 0.0 108.589 169.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -133.41 151.74 51.84 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.139 -0.976 . . . . 0.0 112.995 170.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 mmp_? -134.52 158.71 43.25 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.075 2.55 . . . . 0.0 110.858 -169.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.16 151.02 40.13 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.864 1.266 . . . . 0.0 112.605 174.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -140.3 53.48 1.64 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.048 1.739 . . . . 0.0 109.339 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.68 179.45 5.68 Favored 'General case' 0 CA--C 1.539 0.525 1 CA-C-N 63.723 -24.308 . . . . 0.0 112.284 169.869 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -140.86 149.12 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 127.055 2.142 . . . . 0.0 108.107 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -143.04 162.04 36.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.644 0.778 . . . . 0.0 112.473 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -97.05 135.22 39.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.254 1.421 . . . . 0.0 111.097 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.06 140.9 51.95 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.505 1.522 . . . . 0.0 111.18 172.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -100.04 111.91 24.2 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.282 -169.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.64 -16.25 61.71 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.799 0.839 . . . . 0.0 111.912 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.5 mm -99.89 -45.35 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.425 1.09 . . . . 0.0 111.894 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.5 p -99.02 -8.65 25.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -174.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.316 0.0 OUTLIER 61.59 2.24 0.67 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.864 2.065 . . . . 0.0 115.615 -170.186 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.38 171.13 5.15 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 122.69 1.233 . . . . 0.0 112.54 174.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.9 m -155.98 148.39 23.69 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.667 -1.27 . . . . 0.0 111.227 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -157.75 150.66 23.04 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.173 0.989 . . . . 0.0 111.488 -173.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -83.83 -36.04 23.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.054 0.542 . . . . 0.0 111.86 174.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -74.21 168.89 18.69 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.413 0.685 . . . . 0.0 109.645 169.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.09 134.23 32.03 Favored Pre-proline 0 CA--C 1.546 0.808 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -169.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . 0.286 18.1 Cg_exo 25.62 61.43 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 2 C-N-CA 126.904 5.069 . . . . 0.0 123.431 168.548 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.8 m -78.9 -35.1 44.11 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 168.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.484 0 C-N-CA 126.327 1.918 . . . . 0.0 112.888 169.236 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.3 pttm . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.061 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.67 172.41 6.65 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 125.506 1.522 . . . . 0.0 111.318 -177.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -58.61 176.13 0.47 Allowed 'Trans proline' 0 CA--C 1.551 1.335 0 C-N-CA 124.836 3.69 . . . . 0.0 115.078 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -59.81 177.82 0.44 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.872 3.715 . . . . 0.0 116.333 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.52 37.45 4.26 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.515 1.055 . . . . 0.0 113.852 -178.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -82.02 168.15 18.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.78 157.99 42.71 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 130.334 3.454 . . . . 0.0 109.433 172.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -119.0 125.39 49.27 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.542 -0.724 . . . . 0.0 112.132 -169.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.43 162.11 27.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.891 1.276 . . . . 0.0 113.307 -169.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.3 mtt -119.77 152.1 37.77 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.803 1.241 . . . . 0.0 111.581 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.2 t -131.54 45.74 2.75 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.016 2.126 . . . . 0.0 109.769 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -127.15 160.73 30.33 Favored 'General case' 0 N--CA 1.468 0.442 1 CA-C-N 64.023 -24.171 . . . . 0.0 111.843 169.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -129.62 144.83 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 126.476 1.91 . . . . 0.0 108.686 174.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.2 p90 -148.7 168.32 23.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.126 0.97 . . . . 0.0 111.452 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -118.76 146.86 44.45 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.833 0.825 . . . . 0.0 109.532 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.31 153.17 51.24 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.076 -1.015 . . . . 0.0 110.101 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -97.02 116.21 28.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.518 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -73.91 0.13 14.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.1 mt -113.91 -61.73 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.0 p -81.62 -4.9 57.37 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -175.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 20.2 m-80 60.23 3.05 0.49 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.148 2.579 . . . . 0.0 117.886 169.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.01 106.38 4.87 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.145 -0.972 . . . . 0.0 111.879 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.0 p -80.06 127.58 32.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.548 1.539 . . . . 0.0 111.013 169.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -159.9 162.87 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -169.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -87.35 -21.41 25.7 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -75.88 116.63 16.77 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.313 0.96 . . . . 0.0 110.94 172.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -113.67 145.61 33.76 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 125.504 1.522 . . . . 0.0 113.203 -170.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -72.54 -170.84 0.64 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.972 3.781 . . . . 0.0 112.634 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 76.9 p -75.0 57.17 0.79 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.506 1.522 . . . . 0.0 112.937 172.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.046 1.308 . . . . 0.0 113.089 174.93 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.7 mttp . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 87.2 mt -142.9 174.83 3.29 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 128.311 2.644 . . . . 0.0 107.451 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -57.07 163.86 7.2 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 122.556 2.171 . . . . 0.0 113.116 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.53 178.44 0.93 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.918 3.079 . . . . 0.0 115.069 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.75 71.94 1.28 Allowed Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.309 0.956 . . . . 0.0 112.697 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -126.55 166.87 16.48 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.186 1.395 . . . . 0.0 112.42 -174.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.45 161.15 39.15 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.689 1.995 . . . . 0.0 111.271 171.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.464 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -90.86 156.18 18.21 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.584 1.328 . . . . 0.0 114.584 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -143.68 168.22 20.42 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.957 2.103 . . . . 0.0 109.669 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.5 mtt -121.8 152.25 39.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.048 0.939 . . . . 0.0 111.197 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.1 t -135.34 40.16 2.85 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.5 1.12 . . . . 0.0 112.001 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -120.82 151.2 39.9 Favored 'General case' 0 C--O 1.234 0.252 1 CA-C-N 67.581 -22.554 . . . . 0.0 113.298 168.826 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.97 148.31 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.445 1.898 . . . . 0.0 109.794 173.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -142.69 172.0 13.29 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.672 1.189 . . . . 0.0 110.891 170.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -123.11 142.19 51.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.074 0.95 . . . . 0.0 111.423 -169.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.88 141.98 50.34 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.656 1.182 . . . . 0.0 111.87 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -82.63 119.26 24.05 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.298 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . 0.252 1.4 p80 -84.55 23.86 1.08 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.982 1.265 . . . . 0.0 113.297 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.1 mt -126.76 -50.48 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 126.278 1.831 . . . . 0.0 109.788 172.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 m -92.42 -10.11 39.18 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.429 1.892 . . . . 0.0 112.816 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.272 68.8 m-20 57.6 -11.32 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.851 3.261 . . . . 0.0 117.921 -177.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.31 161.32 1.9 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 111.446 169.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -152.73 150.43 29.41 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.657 -1.277 . . . . 0.0 113.058 -169.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -165.29 -174.57 3.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.372 1.469 . . . . 0.0 110.568 177.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -88.38 -16.25 33.45 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 176.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -73.23 154.32 40.28 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 175.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttt180 -122.97 125.33 26.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.429 1.491 . . . . 0.0 110.548 170.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -74.06 -165.06 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.972 3.115 . . . . 0.0 111.804 169.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.2 p -72.81 64.26 0.66 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.342 1.057 . . . . 0.0 110.252 169.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.324 0 C-N-CA 126.137 1.827 . . . . 0.0 112.039 -174.396 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.0 ptpp? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 94.4 mt -148.96 166.34 15.55 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 126.987 2.115 . . . . 0.0 109.705 -169.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.76 172.98 0.29 Allowed 'Trans proline' 0 CA--C 1.55 1.32 0 C-N-CA 124.915 3.743 . . . . 0.0 114.912 174.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -57.51 179.56 0.13 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 125.014 3.809 . . . . 0.0 117.101 -173.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.1 12.81 38.43 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.77 1.176 . . . . 0.0 114.225 -174.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.0 154.73 37.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -170.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -144.2 163.55 33.31 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 129.96 3.304 . . . . 0.0 109.293 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -115.31 151.87 33.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.2 1.0 . . . . 0.0 110.993 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -147.72 162.66 38.74 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.089 1.756 . . . . 0.0 111.509 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 97.5 mmm -116.92 147.79 41.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.66 1.184 . . . . 0.0 111.313 -178.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t -128.62 45.15 2.83 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.49 1.916 . . . . 0.0 109.832 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -119.43 160.64 21.94 Favored 'General case' 0 N--CA 1.467 0.381 1 CA-C-N 64.551 -23.931 . . . . 0.0 112.637 169.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.3 p -121.56 144.8 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.831 2.052 . . . . 0.0 108.898 169.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -146.05 167.38 23.5 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.573 1.149 . . . . 0.0 111.375 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -114.21 146.94 39.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.663 0.785 . . . . 0.0 109.839 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.27 153.54 51.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.678 1.591 . . . . 0.0 110.758 176.04 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -109.05 121.35 44.95 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -69.67 -23.01 63.4 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 112.999 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.3 mt -97.41 -59.62 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.32 1.448 . . . . 0.0 110.217 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.6 p -79.1 -11.1 59.98 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.351 49.5 m-80 52.81 40.54 30.8 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.897 2.079 . . . . 0.0 115.219 170.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.25 168.4 11.65 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.403 1.881 . . . . 0.0 109.357 169.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 162.06 36.42 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.436 1.095 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.07 161.89 12.84 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.935 1.294 . . . . 0.0 111.429 170.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -82.26 -21.84 36.05 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.308 1.043 . . . . 0.0 112.845 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.62 144.99 26.39 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.047 0.939 . . . . 0.0 109.746 171.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.9 ptt85 -109.23 148.98 39.1 Favored Pre-proline 0 CA--C 1.543 0.679 0 N-CA-C 115.958 1.836 . . . . 0.0 115.958 -168.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.98 48.55 0.5 Allowed 'Trans proline' 0 CA--C 1.548 1.219 1 C-N-CA 126.021 4.481 . . . . 0.0 113.099 170.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.4 p 59.4 -17.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 118.872 2.915 . . . . 0.0 118.872 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.073 0 C-N-CA 126.053 1.787 . . . . 0.0 114.604 169.914 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.9 mttp . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 116.828 -1.558 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.7 tp -129.33 94.86 31.97 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 120.735 1.607 . . . . 0.0 112.481 -169.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -64.56 -28.52 61.4 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.099 3.2 . . . . 0.0 116.523 171.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_exo -66.21 153.66 77.2 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.627 2.885 . . . . 0.0 113.828 169.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.07 7.95 72.96 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 123.911 0.767 . . . . 0.0 114.555 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.421 ' HB2' ' CE2' ' A' ' 16' ' ' TYR . 22.8 m95 -122.71 152.57 40.44 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.511 1.125 . . . . 0.0 112.462 -178.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -106.99 150.59 26.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.628 1.571 . . . . 0.0 111.31 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.9 115.2 25.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.788 2.035 . . . . 0.0 107.437 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -134.29 163.0 30.63 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.691 1.196 . . . . 0.0 112.947 -169.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.14 147.68 51.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.771 1.228 . . . . 0.0 112.522 172.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.4 t -137.07 51.83 1.95 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.972 2.109 . . . . 0.0 109.154 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.21 175.55 8.83 Favored 'General case' 0 CA--C 1.537 0.446 1 CA-C-N 64.161 -24.108 . . . . 0.0 112.342 169.892 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.5 t -116.97 150.53 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 127.177 2.191 . . . . 0.0 107.662 169.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -142.74 166.69 23.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 122.359 1.076 . . . . 0.0 113.293 173.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.421 ' CE2' ' HB2' ' A' ' 6' ' ' TRP . 1.2 t80 -120.19 131.99 55.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.511 2.325 . . . . 0.0 108.834 -176.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.26 139.53 46.98 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.454 1.101 . . . . 0.0 112.784 176.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -86.24 123.53 31.61 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.936 0.494 . . . . 0.0 111.351 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.21 2.99 22.16 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -114.68 -49.54 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.482 1.513 . . . . 0.0 110.143 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 m -93.31 -15.81 25.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.439 1.496 . . . . 0.0 113.013 -174.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 58.88 20.11 7.73 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.645 1.578 . . . . 0.0 114.532 -173.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.8 152.76 44.21 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.381 -0.824 . . . . 0.0 109.717 169.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.0 p -146.31 132.48 19.4 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.296 0.638 . . . . 0.0 112.152 -175.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -155.41 161.55 40.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.301 1.44 . . . . 0.0 110.834 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -72.42 -36.61 68.66 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -170.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.84 176.53 5.08 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.414 1.085 . . . . 0.0 109.106 171.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -59.09 158.13 19.05 Favored Pre-proline 0 N--CA 1.474 0.763 0 C-N-CA 125.048 1.339 . . . . 0.0 111.653 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -73.75 60.53 4.41 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.265 2.643 . . . . 0.0 110.783 169.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -60.43 -38.61 84.65 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 111.871 -174.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 C-N-CA 125.686 1.612 . . . . 0.0 112.127 179.26 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.1 pttm . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 118.744 -0.646 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 55.6 mt -146.9 179.36 1.18 Allowed Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 126.066 1.746 . . . . 0.0 111.335 -169.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.71 178.9 0.6 Allowed 'Trans proline' 0 CA--C 1.554 1.509 0 C-N-CA 124.356 3.371 . . . . 0.0 115.253 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -64.58 -177.35 0.52 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.832 3.688 . . . . 0.0 116.485 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.49 88.61 0.55 Allowed Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.205 1.859 . . . . 0.0 113.21 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -136.93 161.48 35.92 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 -169.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -134.85 133.69 39.98 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.925 2.09 . . . . 0.0 107.695 168.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 130.23 38.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -137.8 163.65 30.86 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.016 -169.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.6 ptm -74.34 146.57 42.97 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.613 0.765 . . . . 0.0 112.585 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 t -132.92 44.82 2.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.427 1.891 . . . . 0.0 109.898 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 -121.81 172.83 7.88 Favored 'General case' 0 N--CA 1.469 0.481 1 CA-C-N 63.71 -24.314 . . . . 0.0 111.602 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.0 p -122.48 147.71 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 126.507 1.923 . . . . 0.0 107.644 169.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -141.55 171.21 14.37 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.098 0.959 . . . . 0.0 112.105 -178.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -116.27 130.21 56.67 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.07 1.748 . . . . 0.0 109.909 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.19 144.71 50.31 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.694 0.759 . . . . 0.0 111.542 169.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -88.91 118.85 28.92 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.87 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.47 -22.81 64.54 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.536 -1.353 . . . . 0.0 112.878 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 39.1 mm -94.85 -56.53 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.312 1.045 . . . . 0.0 110.641 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 m -74.77 -19.31 60.26 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.602 1.561 . . . . 0.0 111.908 -176.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.355 17.1 m-80 59.76 5.02 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 128.434 2.694 . . . . 0.0 116.317 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.96 155.2 40.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.89 1.276 . . . . 0.0 111.191 169.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.5 m -130.73 138.44 49.98 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.451 1.5 . . . . 0.0 110.758 -173.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.09 166.82 31.52 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.396 1.078 . . . . 0.0 112.059 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -95.64 -15.64 22.59 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -74.26 175.28 7.74 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.85 0.833 . . . . 0.0 112.193 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 mtm105 -94.49 179.58 1.18 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.17 1.388 . . . . 0.0 109.55 168.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -54.18 172.64 0.28 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.734 2.956 . . . . 0.0 112.764 168.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -71.19 37.78 0.05 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.509 1.523 . . . . 0.0 114.101 177.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.08 0 C-N-CA 127.884 2.659 . . . . 0.0 109.839 -178.171 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 pttp . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 119.612 -0.233 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 50.0 tp -116.97 -32.78 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 125.855 1.662 . . . . 0.0 114.135 173.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -64.04 172.06 6.66 Favored 'Trans proline' 0 CA--C 1.55 1.294 0 C-N-CA 122.896 2.397 . . . . 0.0 114.662 176.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -63.77 -169.75 0.11 Allowed 'Trans proline' 0 CA--C 1.545 1.061 1 C-N-CA 125.806 4.338 . . . . 0.0 117.138 -176.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.55 -103.82 2.98 Favored Glycine 0 C--N 1.342 0.896 0 N-CA-C 107.419 -2.273 . . . . 0.0 107.419 -169.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -71.04 153.06 42.91 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.655 0.727 . . . . 0.0 110.641 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -135.4 151.78 50.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.873 2.069 . . . . 0.0 110.754 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -97.3 136.37 37.89 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.85 1.26 . . . . 0.0 109.879 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -133.3 165.79 24.0 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.813 2.445 . . . . 0.0 109.952 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 15.8 mmt -121.67 142.14 50.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.632 0.73 . . . . 0.0 112.402 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 p -130.53 73.07 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.355 2.262 . . . . 0.0 108.362 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -113.8 125.22 53.84 Favored 'General case' 0 N--CA 1.471 0.584 1 CA-C-N 67.096 -22.775 . . . . 0.0 110.492 169.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.73 144.56 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.313 1.045 . . . . 0.0 111.022 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -135.72 166.33 23.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.321 0.582 . . . . 0.0 111.011 169.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -128.38 138.72 52.48 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.927 1.291 . . . . 0.0 109.551 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -135.03 148.73 49.99 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.164 0.986 . . . . 0.0 111.175 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -96.16 117.4 30.65 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.873 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -67.42 -15.76 63.85 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.46 -0.775 . . . . 0.0 112.424 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.34 -43.13 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.74 0.816 . . . . 0.0 111.849 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.4 p -123.51 -1.57 8.54 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -173.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.83 6.62 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.399 1.879 . . . . 0.0 115.134 -172.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.99 126.31 20.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.202 -0.936 . . . . 0.0 108.568 169.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 m -139.5 136.03 34.12 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.512 0.725 . . . . 0.0 111.41 -169.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -161.08 163.91 31.13 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.573 1.149 . . . . 0.0 111.676 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -73.26 -49.65 26.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.77 168.83 17.62 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 174.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -111.43 162.28 21.67 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 -167.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.94 -142.82 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.126 1 C-N-CA 125.655 4.237 . . . . 0.0 107.671 167.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.2 t -64.38 48.15 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 126.264 1.825 . . . . 0.0 115.443 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.237 0 C-N-CA 127.149 2.309 . . . . 0.0 115.509 170.357 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -72.45 160.27 83.21 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 123.941 0.896 . . . . 0.0 112.227 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -64.66 154.18 73.66 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.589 2.859 . . . . 0.0 114.939 -171.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -65.32 174.61 4.91 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.747 3.631 . . . . 0.0 116.368 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.56 41.59 1.02 Allowed Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.597 1.57 . . . . 0.0 111.994 -171.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -78.44 170.82 16.03 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -168.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.23 29.83 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.744 3.618 . . . . 0.0 106.622 169.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.09 126.23 36.11 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 111.503 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -136.6 166.46 23.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.713 1.205 . . . . 0.0 111.51 -173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -112.51 140.49 47.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.79 0.836 . . . . 0.0 111.165 -174.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.5 p -138.33 89.15 2.36 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.544 1.938 . . . . 0.0 108.752 -176.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.67 162.72 18.53 Favored 'General case' 0 N--CA 1.472 0.667 1 CA-C-N 69.635 -21.62 . . . . 0.0 113.852 169.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -101.16 141.99 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.507 1.523 . . . . 0.0 107.838 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -136.97 169.62 17.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.525 1.53 . . . . 0.0 111.492 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -110.49 128.13 55.48 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.416 0.687 . . . . 0.0 110.29 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -112.74 143.98 43.04 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.883 0.873 . . . . 0.0 109.651 169.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -88.19 116.85 26.68 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 122.276 -0.265 . . . . 0.0 110.594 -175.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -77.49 0.46 22.68 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.6 mt -117.22 -48.84 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.527 1.931 . . . . 0.0 110.287 176.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.87 -5.36 38.38 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.698 1.599 . . . . 0.0 113.5 -172.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.299 0.2 OUTLIER 52.86 19.44 1.31 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.866 2.066 . . . . 0.0 116.325 -174.174 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.36 173.48 6.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.983 1.313 . . . . 0.0 112.112 171.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 m -153.1 135.69 15.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 111.209 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -145.58 147.04 31.65 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.506 1.122 . . . . 0.0 113.586 -169.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.85 -14.99 25.49 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.99 1.316 . . . . 0.0 112.088 169.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -82.58 -5.22 58.66 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.947 1.699 . . . . 0.0 115.342 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.27 0.0 OUTLIER 34.46 63.46 1.87 Allowed Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 128.256 2.622 . . . . 0.0 113.145 -170.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.96 127.11 21.33 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 123.367 2.711 . . . . 0.0 115.737 -169.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.0 t 48.01 6.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 120.368 3.47 . . . . 0.0 120.368 169.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.972 0 CA-C-O 118.097 -1.391 . . . . 0.0 111.45 172.057 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.93 152.27 84.54 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.404 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -52.9 -33.85 63.56 Favored 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 123.894 3.063 . . . . 0.0 119.757 -169.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -47.02 151.97 2.05 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 123.991 3.127 . . . . 0.0 115.876 -170.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.07 -15.2 3.34 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -168.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.422 ' HE1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 t-105 -117.2 172.64 7.16 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.691 2.245 . . . . 0.0 113.837 -177.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.88 170.92 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.821 2.449 . . . . 0.0 112.144 -169.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.07 140.85 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.226 1.41 . . . . 0.0 112.856 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -141.58 169.73 17.05 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.842 2.057 . . . . 0.0 111.254 -169.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -120.99 145.23 47.97 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.46 1.104 . . . . 0.0 110.458 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.9 t -126.57 38.18 4.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.146 1.779 . . . . 0.0 111.428 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -138.17 157.82 45.53 Favored 'General case' 0 N--CA 1.467 0.402 1 CA-C-N 68.67 -22.059 . . . . 0.0 113.62 169.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.0 t -93.76 145.04 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.971 1.709 . . . . 0.0 109.356 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -137.36 167.79 20.91 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.902 1.281 . . . . 0.0 110.679 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.422 ' HB3' ' HE1' ' A' ' 6' ' ' TRP . 27.2 m-85 -129.65 139.93 51.28 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.578 0.751 . . . . 0.0 109.858 -175.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -145.24 151.16 37.94 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -170.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -78.94 120.73 23.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.825 1.65 . . . . 0.0 110.426 173.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -81.21 7.6 10.89 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.9 mt -124.15 -45.47 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 126.271 1.828 . . . . 0.0 110.18 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -105.14 -4.16 22.16 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.33 1.852 . . . . 0.0 112.978 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.296 0.2 OUTLIER 54.49 6.58 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.578 2.351 . . . . 0.0 117.245 -176.769 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.65 122.98 10.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.2 m -131.11 136.35 48.3 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.378 1.071 . . . . 0.0 110.791 -169.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -139.23 143.62 38.1 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.357 1.063 . . . . 0.0 113.299 -171.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -101.34 -14.19 17.71 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.684 1.594 . . . . 0.0 110.517 169.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.92 -6.05 58.2 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 127.894 2.477 . . . . 0.0 114.127 173.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.358 0.0 OUTLIER 60.81 151.27 0.1 OUTLIER Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 131.105 3.762 . . . . 0.0 114.009 -169.446 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -22.94 141.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.965 1 C-N-CA 130.284 7.323 . . . . 0.0 118.958 -172.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.4 p -55.55 87.63 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.817 2.047 . . . . 0.0 113.255 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 C-N-CA 130.074 3.702 . . . . 0.0 106.894 -174.044 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 34.4 mt -83.06 160.92 59.31 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.268 1.027 . . . . 0.0 110.796 169.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.13 156.71 65.1 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.303 2.669 . . . . 0.0 113.362 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -79.04 170.49 17.76 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.242 3.294 . . . . 0.0 112.419 175.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.14 87.28 0.26 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.435 1.017 . . . . 0.0 114.197 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -122.12 163.51 19.37 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.285 1.034 . . . . 0.0 113.456 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.21 155.98 44.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.984 2.114 . . . . 0.0 110.093 174.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -84.2 152.97 23.91 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.384 0.674 . . . . 0.0 111.221 169.62 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -144.0 168.2 20.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.26 2.224 . . . . 0.0 109.09 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 tpt -118.76 158.41 25.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.987 0.898 . . . . 0.0 111.993 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.2 m -160.18 110.95 1.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.925 1.29 . . . . 0.0 110.455 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.7 tpt85 -107.96 139.06 43.15 Favored 'General case' 0 N--CA 1.469 0.497 1 CA-C-N 69.683 -21.599 . . . . 0.0 112.579 174.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 p -85.29 141.84 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.445 1.098 . . . . 0.0 108.914 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -134.53 169.65 16.95 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.311 1.044 . . . . 0.0 111.051 173.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -118.65 136.99 53.6 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.159 1.384 . . . . 0.0 110.815 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -137.53 144.96 42.39 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 123.813 0.845 . . . . 0.0 112.689 -173.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -85.24 116.71 23.75 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.151 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -83.36 20.0 1.41 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -124.53 -44.8 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 126.276 1.831 . . . . 0.0 110.243 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 m -104.22 -12.77 16.48 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.584 1.954 . . . . 0.0 113.167 -169.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.324 0.0 OUTLIER 61.02 -4.17 0.14 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 128.191 2.596 . . . . 0.0 116.984 -170.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -43.77 121.95 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.143 1.377 . . . . 0.0 109.626 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -130.13 135.44 48.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.407 1.083 . . . . 0.0 111.42 -169.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -157.45 156.76 32.71 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.197 1.399 . . . . 0.0 110.549 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -66.71 -32.22 73.39 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.53 -1.356 . . . . 0.0 114.064 -176.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -120.99 174.17 6.79 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.79 1.236 . . . . 0.0 112.29 -179.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.7 mtm-85 -69.7 156.12 92.28 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.788 1.235 . . . . 0.0 112.412 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -56.27 149.19 56.48 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.277 2.652 . . . . 0.0 113.199 170.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.4 p -78.56 18.75 0.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.74 1.616 . . . . 0.0 114.176 173.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 C-N-CA 126.238 1.875 . . . . 0.0 112.416 -171.079 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.131 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 17.0 mt -154.88 163.25 25.06 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.787 1.635 . . . . 0.0 111.11 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -56.51 168.4 2.21 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.805 3.67 . . . . 0.0 115.376 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -54.8 162.73 4.67 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.708 3.605 . . . . 0.0 115.989 -175.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.64 95.42 1.12 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -169.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 48.3 m95 -144.41 166.7 24.35 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.454 1.501 . . . . 0.0 111.113 -173.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -137.01 152.25 49.9 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.513 1.525 . . . . 0.0 110.325 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -105.66 127.52 53.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.679 1.591 . . . . 0.0 107.981 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -141.71 170.26 16.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.005 0.922 . . . . 0.0 112.285 -169.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.6 tpt -107.11 156.76 18.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 0.0 111.403 172.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.7 p -147.73 84.51 1.54 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.283 1.833 . . . . 0.0 109.152 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.6 164.62 22.47 Favored 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 68.208 -22.269 . . . . 0.0 113.114 172.822 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 p -96.36 147.5 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 126.134 1.773 . . . . 0.0 108.957 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -140.75 163.87 31.73 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.633 0.73 . . . . 0.0 112.695 174.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -123.72 133.52 53.85 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.338 1.055 . . . . 0.0 110.208 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.88 146.54 42.86 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.008 -1.058 . . . . 0.0 111.298 177.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.36 121.81 24.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.736 174.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -77.77 -11.68 59.9 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.9 -46.32 11.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 125.505 1.522 . . . . 0.0 110.649 173.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.7 -8.01 26.87 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.299 1.04 . . . . 0.0 113.644 -169.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.298 0.0 OUTLIER 60.81 -12.33 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.338 3.055 . . . . 0.0 118.002 -176.623 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.97 111.46 0.56 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.492 1.117 . . . . 0.0 111.008 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 m -96.29 122.62 39.35 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 125.758 1.623 . . . . 0.0 108.792 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -151.74 168.19 25.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 -168.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -92.0 -17.22 25.4 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.574 0.75 . . . . 0.0 112.945 173.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -69.96 151.39 45.66 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.056 0.389 . . . . 0.0 110.114 169.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.1 mtm105 -138.57 151.29 68.65 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.064 -169.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -78.1 -170.8 1.04 Allowed 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 123.96 3.107 . . . . 0.0 109.657 169.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 90.5 p -70.63 72.16 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.708 1.203 . . . . 0.0 112.296 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.75 1.643 . . . . 0.0 112.075 177.585 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.6 mttm . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.65 160.69 81.58 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -70.85 159.58 52.14 Favored 'Trans proline' 0 CA--C 1.546 1.102 0 C-N-CA 123.963 3.109 . . . . 0.0 115.238 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.55 163.78 33.52 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 124.906 3.737 . . . . 0.0 114.849 -176.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.05 50.89 0.66 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.595 1.569 . . . . 0.0 111.174 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -83.66 165.06 19.28 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 -169.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.97 157.53 34.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 129.971 3.309 . . . . 0.0 108.62 169.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.31 134.84 48.83 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.516 1.127 . . . . 0.0 112.405 -175.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -137.86 161.99 35.16 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.47 1.508 . . . . 0.0 111.902 -169.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.7 ptm -87.31 141.91 28.29 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.129 0.972 . . . . 0.0 112.967 -176.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.8 t -129.46 46.56 2.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 109.654 176.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -130.4 168.09 17.53 Favored 'General case' 0 CA--C 1.537 0.447 1 CA-C-N 64.323 -24.035 . . . . 0.0 111.82 169.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -112.37 148.33 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.701 2.0 . . . . 0.0 108.209 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -136.28 169.6 17.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.24 1.016 . . . . 0.0 111.905 174.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.73 130.13 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.619 1.568 . . . . 0.0 110.391 -176.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.33 146.56 51.94 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.43 1.092 . . . . 0.0 111.177 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -87.92 116.82 26.36 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.089 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -77.18 -0.09 23.75 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.69 -45.2 7.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 125.775 1.63 . . . . 0.0 110.342 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.0 t -126.89 12.37 7.26 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 -171.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.293 0.0 OUTLIER 61.61 -10.2 0.07 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 128.78 2.832 . . . . 0.0 118.0 176.701 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.32 122.37 2.19 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.785 1.634 . . . . 0.0 110.473 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -128.93 135.05 48.5 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.358 1.063 . . . . 0.0 112.926 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -156.38 168.22 28.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.482 1.513 . . . . 0.0 111.039 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -80.18 -14.37 58.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.559 -1.338 . . . . 0.0 113.488 171.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -96.84 158.7 15.31 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -171.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.34 149.89 36.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.121 1.368 . . . . 0.0 109.648 168.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -59.97 110.19 0.72 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.654 2.902 . . . . 0.0 111.961 -174.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -158.92 46.84 0.31 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.869 1.668 . . . . 0.0 110.077 -170.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 CA-C-O 117.619 -1.656 . . . . 0.0 110.17 -169.649 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.41 ' HA ' ' CE ' ' A' ' 1' ' ' LYS . 6.0 mmmt . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.6 tt -146.95 111.93 4.14 Favored Pre-proline 0 CA--C 1.544 0.736 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -80.98 148.87 17.41 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.661 2.24 . . . . 0.0 112.686 -174.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -69.83 167.88 23.24 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.323 2.682 . . . . 0.0 112.274 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.64 65.8 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-O 119.014 -0.881 . . . . 0.0 114.933 176.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -122.07 162.43 21.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.746 1.273 . . . . 0.0 112.849 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -146.42 156.33 43.22 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.39 1.876 . . . . 0.0 110.929 -177.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 143.3 29.64 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.912 1.285 . . . . 0.0 112.506 -178.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -144.39 168.06 20.98 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.022 1.329 . . . . 0.0 111.495 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -123.26 134.82 54.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.237 1.015 . . . . 0.0 111.044 -174.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.0 t -113.61 42.97 1.87 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.393 2.277 . . . . 0.0 110.173 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.26 135.14 54.46 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 66.558 -23.019 . . . . 0.0 111.317 169.849 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.72 142.99 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.257 1.023 . . . . 0.0 111.231 170.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -133.98 167.43 20.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.071 1.348 . . . . 0.0 111.379 170.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.18 140.29 53.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.863 1.265 . . . . 0.0 110.161 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.66 147.37 51.42 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 124.282 1.033 . . . . 0.0 111.997 -171.199 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -86.98 120.94 28.77 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.055 0.942 . . . . 0.0 109.69 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -71.96 -9.86 58.96 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.23 1.012 . . . . 0.0 113.033 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mt -109.42 -62.4 2.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.127 1.371 . . . . 0.0 109.681 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.9 p -80.2 -8.67 59.55 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -171.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 60.14 1.06 0.32 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.917 2.087 . . . . 0.0 114.929 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.09 128.78 19.73 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.727 1.211 . . . . 0.0 109.318 169.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.9 m -133.53 132.36 40.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.871 0.869 . . . . 0.0 110.605 -169.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -151.64 152.11 32.39 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.61 1.164 . . . . 0.0 110.99 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -66.11 -40.28 90.61 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -173.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -108.38 145.61 34.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.083 177.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -69.63 158.1 87.87 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -56.69 138.37 84.84 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.239 1.959 . . . . 0.0 109.858 168.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 85.9 p -90.43 -0.4 57.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -172.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.142 0 C-N-CA 126.684 2.087 . . . . 0.0 114.65 -170.839 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.9 mmtm . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -85.48 -31.29 0.44 Allowed Pre-proline 0 CA--C 1.549 0.913 0 CA-C-O 116.584 -1.675 . . . . 0.0 114.797 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -60.16 -22.43 70.03 Favored 'Trans proline' 0 CA--C 1.55 1.285 0 N-CA-C 118.87 2.604 . . . . 0.0 118.87 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -59.52 161.93 16.24 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.564 2.176 . . . . 0.0 113.386 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -69.34 68.49 0.52 Allowed Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.656 1.122 . . . . 0.0 113.651 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -75.04 156.72 35.87 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.722 1.248 . . . . 0.0 112.917 174.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -140.22 153.35 46.54 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.783 2.433 . . . . 0.0 109.587 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -100.79 144.42 29.78 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.263 1.025 . . . . 0.0 110.341 -176.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -142.81 166.38 24.79 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.399 1.88 . . . . 0.0 109.918 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -122.76 150.47 42.74 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.541 0.736 . . . . 0.0 111.718 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.2 m -159.65 125.05 4.13 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.685 0.794 . . . . 0.0 111.474 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.0 ttt85 -117.98 154.95 31.11 Favored 'General case' 0 N--CA 1.472 0.646 1 CA-C-N 68.864 -21.971 . . . . 0.0 113.246 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -103.34 133.82 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.27 171.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -126.55 165.24 19.52 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.454 1.901 . . . . 0.0 111.813 -177.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -115.3 135.38 54.21 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.802 0.841 . . . . 0.0 111.355 -172.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.61 151.39 50.27 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.557 1.543 . . . . 0.0 110.829 174.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -103.46 116.48 32.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.834 0.854 . . . . 0.0 111.099 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -71.03 -16.65 62.62 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.48 -0.762 . . . . 0.0 112.873 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 52.5 mt -94.11 -44.21 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.453 1.101 . . . . 0.0 110.826 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 p -106.93 -6.96 17.23 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.32 0.2 OUTLIER 53.04 17.27 0.88 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.897 2.079 . . . . 0.0 116.083 -170.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.7 160.18 32.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.324 0.65 . . . . 0.0 110.515 169.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.8 p -145.44 157.11 44.07 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.649 0.78 . . . . 0.0 111.936 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -152.74 146.68 25.3 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.498 1.119 . . . . 0.0 111.066 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -44.99 77.15 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.783 0.433 . . . . 0.0 110.629 -172.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -96.96 143.84 27.44 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.183 0.993 . . . . 0.0 110.541 169.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.515 ' H ' ' NE ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -61.24 153.2 69.11 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 125.218 1.407 . . . . 0.0 110.916 169.737 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -53.29 136.3 62.25 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 121.86 1.707 . . . . 0.0 112.965 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 p -78.36 -9.25 59.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.795 1.238 . . . . 0.0 113.828 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.139 0 C-N-CA 127.953 2.692 . . . . 0.0 110.052 179.304 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 73.0 m95 . . . . . 0 CA--C 1.532 0.287 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -136.8 157.09 47.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.834 2.053 . . . . 0.0 110.362 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.16 140.45 29.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.642 0.777 . . . . 0.0 111.628 169.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -132.39 161.13 34.39 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.324 2.25 . . . . 0.0 110.797 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.43 138.2 43.04 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.74 1.616 . . . . 0.0 112.74 -178.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 CA--C 1.534 0.365 0 C-N-CA 125.97 1.708 . . . . 0.0 108.531 173.52 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpt85 . . . . . 0 N--CA 1.47 0.551 0 CA-C-O 121.177 0.513 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.05 143.21 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 124.976 1.31 . . . . 0.0 108.776 169.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -134.89 173.6 11.53 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.215 1.406 . . . . 0.0 110.79 171.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -121.3 137.1 54.84 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.639 1.175 . . . . 0.0 109.701 -176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.38 147.36 43.32 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.308 1.043 . . . . 0.0 112.387 -176.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -93.73 116.92 29.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.123 0.569 . . . . 0.0 111.142 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -68.29 -22.15 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.935 0.894 . . . . 0.0 112.519 -178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -95.89 -40.67 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.501 1.12 . . . . 0.0 111.254 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.87 -5.54 17.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.34 1.456 . . . . 0.0 113.467 -169.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.321 0.0 OUTLIER 59.79 -8.6 0.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.191 2.996 . . . . 0.0 118.103 -178.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.33 138.43 39.34 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.121 0.873 . . . . 0.0 111.758 173.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.1 p -140.2 128.47 22.5 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.763 1.225 . . . . 0.0 111.03 -170.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -152.77 151.95 31.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.023 0.929 . . . . 0.0 112.39 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.868 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.7 m95 . . . . . 0 C--O 1.228 -0.05 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -141.48 166.41 24.83 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 127.962 2.505 . . . . 0.0 108.589 169.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -133.41 151.74 51.84 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.139 -0.976 . . . . 0.0 112.995 170.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 mmp_? -134.52 158.71 43.25 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.075 2.55 . . . . 0.0 110.858 -169.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.16 151.02 40.13 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.864 1.266 . . . . 0.0 112.605 174.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 126.048 1.739 . . . . 0.0 109.339 174.601 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.525 0 CA-C-O 121.692 0.758 . . . . 0.0 112.284 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -140.86 149.12 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 127.055 2.142 . . . . 0.0 108.107 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -143.04 162.04 36.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.644 0.778 . . . . 0.0 112.473 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -97.05 135.22 39.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.254 1.421 . . . . 0.0 111.097 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.06 140.9 51.95 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.505 1.522 . . . . 0.0 111.18 172.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -100.04 111.91 24.2 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.282 -169.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.64 -16.25 61.71 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.799 0.839 . . . . 0.0 111.912 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.5 mm -99.89 -45.35 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.425 1.09 . . . . 0.0 111.894 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.5 p -99.02 -8.65 25.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -174.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.316 0.0 OUTLIER 61.59 2.24 0.67 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.864 2.065 . . . . 0.0 115.615 -170.186 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.38 171.13 5.15 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 122.69 1.233 . . . . 0.0 112.54 174.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.9 m -155.98 148.39 23.69 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.667 -1.27 . . . . 0.0 111.227 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -157.75 150.66 23.04 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.173 0.989 . . . . 0.0 111.488 -173.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 123.054 0.542 . . . . 0.0 111.86 174.411 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 . . . . . 0 CA--C 1.54 0.581 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.78 157.99 42.71 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 130.334 3.454 . . . . 0.0 109.433 172.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -119.0 125.39 49.27 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.542 -0.724 . . . . 0.0 112.132 -169.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.43 162.11 27.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.891 1.276 . . . . 0.0 113.307 -169.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.3 mtt -119.77 152.1 37.77 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.803 1.241 . . . . 0.0 111.581 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.2 t . . . . . 0 CA--C 1.543 0.678 0 C-N-CA 127.016 2.126 . . . . 0.0 109.769 179.145 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? . . . . . 0 N--CA 1.468 0.442 0 CA-C-O 121.28 0.562 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -129.62 144.83 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 126.476 1.91 . . . . 0.0 108.686 174.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.2 p90 -148.7 168.32 23.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.126 0.97 . . . . 0.0 111.452 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -118.76 146.86 44.45 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.833 0.825 . . . . 0.0 109.532 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.31 153.17 51.24 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.076 -1.015 . . . . 0.0 110.101 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -97.02 116.21 28.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.518 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -73.91 0.13 14.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.1 mt -113.91 -61.73 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.0 p -81.62 -4.9 57.37 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -175.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 20.2 m-80 60.23 3.05 0.49 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.148 2.579 . . . . 0.0 117.886 169.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.01 106.38 4.87 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.145 -0.972 . . . . 0.0 111.879 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.0 p -80.06 127.58 32.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.548 1.539 . . . . 0.0 111.013 169.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -159.9 162.87 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -169.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.179 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 31.8 m95 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.45 161.15 39.15 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.689 1.995 . . . . 0.0 111.271 171.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.464 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -90.86 156.18 18.21 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.584 1.328 . . . . 0.0 114.584 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -143.68 168.22 20.42 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.957 2.103 . . . . 0.0 109.669 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.5 mtt -121.8 152.25 39.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.048 0.939 . . . . 0.0 111.197 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 N--CA 1.471 0.614 0 C-N-CA 124.5 1.12 . . . . 0.0 112.001 -175.814 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.252 0 N-CA-C 113.298 0.851 . . . . 0.0 113.298 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.97 148.31 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.445 1.898 . . . . 0.0 109.794 173.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -142.69 172.0 13.29 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.672 1.189 . . . . 0.0 110.891 170.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -123.11 142.19 51.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.074 0.95 . . . . 0.0 111.423 -169.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.88 141.98 50.34 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.656 1.182 . . . . 0.0 111.87 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -82.63 119.26 24.05 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.298 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . 0.252 1.4 p80 -84.55 23.86 1.08 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.982 1.265 . . . . 0.0 113.297 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.1 mt -126.76 -50.48 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 126.278 1.831 . . . . 0.0 109.788 172.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 m -92.42 -10.11 39.18 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.429 1.892 . . . . 0.0 112.816 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.272 68.8 m-20 57.6 -11.32 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.851 3.261 . . . . 0.0 117.921 -177.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.31 161.32 1.9 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 111.446 169.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -152.73 150.43 29.41 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.657 -1.277 . . . . 0.0 113.058 -169.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -165.29 -174.57 3.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.372 1.469 . . . . 0.0 110.568 177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 176.86 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 . . . . . 0 CA--C 1.538 0.501 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -144.2 163.55 33.31 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 129.96 3.304 . . . . 0.0 109.293 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -115.31 151.87 33.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.2 1.0 . . . . 0.0 110.993 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -147.72 162.66 38.74 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.089 1.756 . . . . 0.0 111.509 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 97.5 mmm -116.92 147.79 41.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.66 1.184 . . . . 0.0 111.313 -178.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t . . . . . 0 CA--C 1.543 0.699 0 C-N-CA 126.49 1.916 . . . . 0.0 109.832 178.55 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 . . . . . 0 N--CA 1.467 0.381 0 CA-C-O 121.403 0.62 . . . . 0.0 112.637 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.3 p -121.56 144.8 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.831 2.052 . . . . 0.0 108.898 169.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -146.05 167.38 23.5 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.573 1.149 . . . . 0.0 111.375 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -114.21 146.94 39.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.663 0.785 . . . . 0.0 109.839 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.27 153.54 51.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.678 1.591 . . . . 0.0 110.758 176.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -109.05 121.35 44.95 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -69.67 -23.01 63.4 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 112.999 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.3 mt -97.41 -59.62 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.32 1.448 . . . . 0.0 110.217 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.6 p -79.1 -11.1 59.98 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.351 49.5 m-80 52.81 40.54 30.8 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.897 2.079 . . . . 0.0 115.219 170.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.25 168.4 11.65 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.403 1.881 . . . . 0.0 109.357 169.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 162.06 36.42 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.436 1.095 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.07 161.89 12.84 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.935 1.294 . . . . 0.0 111.429 170.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 N--CA 1.47 0.559 0 C-N-CA 124.308 1.043 . . . . 0.0 112.845 177.601 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.421 ' HB2' ' CE2' ' A' ' 16' ' ' TYR . 22.8 m95 . . . . . 0 C--O 1.235 0.324 0 CA-C-O 121.782 0.801 . . . . 0.0 112.462 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -106.99 150.59 26.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.628 1.571 . . . . 0.0 111.31 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.9 115.2 25.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.788 2.035 . . . . 0.0 107.437 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -134.29 163.0 30.63 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.691 1.196 . . . . 0.0 112.947 -169.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.14 147.68 51.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.771 1.228 . . . . 0.0 112.522 172.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 CA--C 1.542 0.657 0 C-N-CA 126.972 2.109 . . . . 0.0 109.154 176.137 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.446 0 CA-C-O 121.63 0.729 . . . . 0.0 112.342 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.5 t -116.97 150.53 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 127.177 2.191 . . . . 0.0 107.662 169.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -142.74 166.69 23.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 122.359 1.076 . . . . 0.0 113.293 173.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.421 ' CE2' ' HB2' ' A' ' 6' ' ' TRP . 1.2 t80 -120.19 131.99 55.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.511 2.325 . . . . 0.0 108.834 -176.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.26 139.53 46.98 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.454 1.101 . . . . 0.0 112.784 176.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -86.24 123.53 31.61 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.936 0.494 . . . . 0.0 111.351 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.21 2.99 22.16 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -114.68 -49.54 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.482 1.513 . . . . 0.0 110.143 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 m -93.31 -15.81 25.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.439 1.496 . . . . 0.0 113.013 -174.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 58.88 20.11 7.73 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.645 1.578 . . . . 0.0 114.532 -173.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.8 152.76 44.21 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.381 -0.824 . . . . 0.0 109.717 169.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.0 p -146.31 132.48 19.4 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.296 0.638 . . . . 0.0 112.152 -175.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -155.41 161.55 40.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.301 1.44 . . . . 0.0 110.834 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -170.577 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 m95 . . . . . 0 N--CA 1.472 0.632 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -134.85 133.69 39.98 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.925 2.09 . . . . 0.0 107.695 168.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 130.23 38.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -137.8 163.65 30.86 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.016 -169.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.6 ptm -74.34 146.57 42.97 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.613 0.765 . . . . 0.0 112.585 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 t . . . . . 0 CA--C 1.541 0.626 0 C-N-CA 126.427 1.891 . . . . 0.0 109.898 179.22 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 . . . . . 0 N--CA 1.469 0.481 0 CA-C-O 121.82 0.819 . . . . 0.0 111.602 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.0 p -122.48 147.71 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 126.507 1.923 . . . . 0.0 107.644 169.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -141.55 171.21 14.37 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.098 0.959 . . . . 0.0 112.105 -178.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -116.27 130.21 56.67 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.07 1.748 . . . . 0.0 109.909 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.19 144.71 50.31 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.694 0.759 . . . . 0.0 111.542 169.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -88.91 118.85 28.92 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.87 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.47 -22.81 64.54 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.536 -1.353 . . . . 0.0 112.878 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 39.1 mm -94.85 -56.53 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.312 1.045 . . . . 0.0 110.641 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 m -74.77 -19.31 60.26 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.602 1.561 . . . . 0.0 111.908 -176.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.355 17.1 m-80 59.76 5.02 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 128.434 2.694 . . . . 0.0 116.317 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.96 155.2 40.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.89 1.276 . . . . 0.0 111.191 169.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.5 m -130.73 138.44 49.98 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.451 1.5 . . . . 0.0 110.758 -173.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.09 166.82 31.52 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.396 1.078 . . . . 0.0 112.059 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.401 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.4 m95 . . . . . 0 CA--C 1.532 0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.641 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -135.4 151.78 50.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.873 2.069 . . . . 0.0 110.754 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -97.3 136.37 37.89 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.85 1.26 . . . . 0.0 109.879 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -133.3 165.79 24.0 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.813 2.445 . . . . 0.0 109.952 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 15.8 mmt -121.67 142.14 50.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.632 0.73 . . . . 0.0 112.402 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 p . . . . . 0 CA--C 1.534 0.364 0 C-N-CA 127.355 2.262 . . . . 0.0 108.362 176.407 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 . . . . . 0 N--CA 1.471 0.584 0 CA-C-O 120.531 0.205 . . . . 0.0 110.492 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.73 144.56 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.313 1.045 . . . . 0.0 111.022 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -135.72 166.33 23.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.321 0.582 . . . . 0.0 111.011 169.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -128.38 138.72 52.48 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.927 1.291 . . . . 0.0 109.551 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -135.03 148.73 49.99 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.164 0.986 . . . . 0.0 111.175 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -96.16 117.4 30.65 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.873 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -67.42 -15.76 63.85 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.46 -0.775 . . . . 0.0 112.424 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.34 -43.13 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.74 0.816 . . . . 0.0 111.849 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.4 p -123.51 -1.57 8.54 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -173.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.83 6.62 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.399 1.879 . . . . 0.0 115.134 -172.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.99 126.31 20.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.202 -0.936 . . . . 0.0 108.568 169.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 m -139.5 136.03 34.12 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.512 0.725 . . . . 0.0 111.41 -169.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -161.08 163.91 31.13 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.573 1.149 . . . . 0.0 111.676 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 . . . . . 0 N--CA 1.468 0.473 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -177.935 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 41.8 m95 . . . . . 0 CA--C 1.535 0.381 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.23 29.83 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.744 3.618 . . . . 0.0 106.622 169.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.09 126.23 36.11 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 111.503 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -136.6 166.46 23.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.713 1.205 . . . . 0.0 111.51 -173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -112.51 140.49 47.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.79 0.836 . . . . 0.0 111.165 -174.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.5 p . . . . . 0 C--O 1.239 0.519 0 C-N-CA 126.544 1.938 . . . . 0.0 108.752 -176.268 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.667 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -101.16 141.99 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.507 1.523 . . . . 0.0 107.838 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -136.97 169.62 17.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.525 1.53 . . . . 0.0 111.492 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -110.49 128.13 55.48 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.416 0.687 . . . . 0.0 110.29 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -112.74 143.98 43.04 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.883 0.873 . . . . 0.0 109.651 169.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -88.19 116.85 26.68 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 122.276 -0.265 . . . . 0.0 110.594 -175.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -77.49 0.46 22.68 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.6 mt -117.22 -48.84 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.527 1.931 . . . . 0.0 110.287 176.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.87 -5.36 38.38 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.698 1.599 . . . . 0.0 113.5 -172.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.299 0.2 OUTLIER 52.86 19.44 1.31 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.866 2.066 . . . . 0.0 116.325 -174.174 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.36 173.48 6.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.983 1.313 . . . . 0.0 112.112 171.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 m -153.1 135.69 15.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 111.209 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -145.58 147.04 31.65 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.506 1.122 . . . . 0.0 113.586 -169.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 . . . . . 0 CA--C 1.541 0.598 0 C-N-CA 124.99 1.316 . . . . 0.0 112.088 169.605 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.422 ' HE1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 t-105 . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 123.054 1.407 . . . . 0.0 113.837 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.88 170.92 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.821 2.449 . . . . 0.0 112.144 -169.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.07 140.85 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.226 1.41 . . . . 0.0 112.856 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -141.58 169.73 17.05 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.842 2.057 . . . . 0.0 111.254 -169.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -120.99 145.23 47.97 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.46 1.104 . . . . 0.0 110.458 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 CA--C 1.539 0.52 0 C-N-CA 126.146 1.779 . . . . 0.0 111.428 -177.206 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.0 t -93.76 145.04 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.971 1.709 . . . . 0.0 109.356 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -137.36 167.79 20.91 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.902 1.281 . . . . 0.0 110.679 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.422 ' HB3' ' HE1' ' A' ' 6' ' ' TRP . 27.2 m-85 -129.65 139.93 51.28 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.578 0.751 . . . . 0.0 109.858 -175.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -145.24 151.16 37.94 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -170.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -78.94 120.73 23.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.825 1.65 . . . . 0.0 110.426 173.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -81.21 7.6 10.89 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.9 mt -124.15 -45.47 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 126.271 1.828 . . . . 0.0 110.18 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -105.14 -4.16 22.16 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.33 1.852 . . . . 0.0 112.978 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.296 0.2 OUTLIER 54.49 6.58 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.578 2.351 . . . . 0.0 117.245 -176.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.65 122.98 10.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.2 m -131.11 136.35 48.3 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.378 1.071 . . . . 0.0 110.791 -169.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -139.23 143.62 38.1 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.357 1.063 . . . . 0.0 113.299 -171.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 125.684 1.594 . . . . 0.0 110.517 169.347 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 55.8 m95 . . . . . 0 N--CA 1.467 0.407 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.21 155.98 44.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.984 2.114 . . . . 0.0 110.093 174.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -84.2 152.97 23.91 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.384 0.674 . . . . 0.0 111.221 169.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -144.0 168.2 20.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.26 2.224 . . . . 0.0 109.09 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 tpt -118.76 158.41 25.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.987 0.898 . . . . 0.0 111.993 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--N 1.331 -0.229 0 C-N-CA 124.925 1.29 . . . . 0.0 110.455 172.485 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.7 tpt85 . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 121.421 0.629 . . . . 0.0 112.579 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 p -85.29 141.84 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.445 1.098 . . . . 0.0 108.914 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -134.53 169.65 16.95 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.311 1.044 . . . . 0.0 111.051 173.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -118.65 136.99 53.6 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.159 1.384 . . . . 0.0 110.815 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -137.53 144.96 42.39 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 123.813 0.845 . . . . 0.0 112.689 -173.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -85.24 116.71 23.75 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.151 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -83.36 20.0 1.41 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -124.53 -44.8 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 126.276 1.831 . . . . 0.0 110.243 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 m -104.22 -12.77 16.48 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.584 1.954 . . . . 0.0 113.167 -169.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.324 0.0 OUTLIER 61.02 -4.17 0.14 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 128.191 2.596 . . . . 0.0 116.984 -170.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -43.77 121.95 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.143 1.377 . . . . 0.0 109.626 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -130.13 135.44 48.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.407 1.083 . . . . 0.0 111.42 -169.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -157.45 156.76 32.71 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.197 1.399 . . . . 0.0 110.549 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 . . . . . 0 N--CA 1.474 0.732 0 O-C-N 120.53 -1.356 . . . . 0.0 114.064 -176.02 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 48.3 m95 . . . . . 0 CA--C 1.537 0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -137.01 152.25 49.9 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.513 1.525 . . . . 0.0 110.325 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -105.66 127.52 53.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.679 1.591 . . . . 0.0 107.981 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -141.71 170.26 16.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.005 0.922 . . . . 0.0 112.285 -169.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.6 tpt -107.11 156.76 18.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 0.0 111.403 172.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.7 p . . . . . 0 CA--C 1.537 0.45 0 C-N-CA 126.283 1.833 . . . . 0.0 109.152 178.569 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.47 0.56 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 p -96.36 147.5 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 126.134 1.773 . . . . 0.0 108.957 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -140.75 163.87 31.73 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.633 0.73 . . . . 0.0 112.695 174.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -123.72 133.52 53.85 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.338 1.055 . . . . 0.0 110.208 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.88 146.54 42.86 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.008 -1.058 . . . . 0.0 111.298 177.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.36 121.81 24.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.736 174.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -77.77 -11.68 59.9 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.9 -46.32 11.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 125.505 1.522 . . . . 0.0 110.649 173.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.7 -8.01 26.87 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.299 1.04 . . . . 0.0 113.644 -169.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.298 0.0 OUTLIER 60.81 -12.33 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.338 3.055 . . . . 0.0 118.002 -176.623 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.97 111.46 0.56 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.492 1.117 . . . . 0.0 111.008 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 m -96.29 122.62 39.35 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 125.758 1.623 . . . . 0.0 108.792 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -151.74 168.19 25.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 -168.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 . . . . . 0 N--CA 1.469 0.517 0 C-N-CA 123.574 0.75 . . . . 0.0 112.945 173.621 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.97 157.53 34.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 129.971 3.309 . . . . 0.0 108.62 169.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.31 134.84 48.83 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.516 1.127 . . . . 0.0 112.405 -175.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -137.86 161.99 35.16 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.47 1.508 . . . . 0.0 111.902 -169.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.7 ptm -87.31 141.91 28.29 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.129 0.972 . . . . 0.0 112.967 -176.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.8 t . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 109.654 176.379 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 CA--C 1.537 0.447 0 CA-C-O 121.451 0.643 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -112.37 148.33 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.701 2.0 . . . . 0.0 108.209 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -136.28 169.6 17.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.24 1.016 . . . . 0.0 111.905 174.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.73 130.13 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.619 1.568 . . . . 0.0 110.391 -176.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.33 146.56 51.94 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.43 1.092 . . . . 0.0 111.177 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -87.92 116.82 26.36 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.089 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -77.18 -0.09 23.75 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.69 -45.2 7.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 125.775 1.63 . . . . 0.0 110.342 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.0 t -126.89 12.37 7.26 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 -171.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.293 0.0 OUTLIER 61.61 -10.2 0.07 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 128.78 2.832 . . . . 0.0 118.0 176.701 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.32 122.37 2.19 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.785 1.634 . . . . 0.0 110.473 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -128.93 135.05 48.5 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.358 1.063 . . . . 0.0 112.926 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -156.38 168.22 28.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.482 1.513 . . . . 0.0 111.039 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 . . . . . 0 N--CA 1.475 0.815 0 O-C-N 120.559 -1.338 . . . . 0.0 113.488 171.744 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 m95 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -146.42 156.33 43.22 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.39 1.876 . . . . 0.0 110.929 -177.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 143.3 29.64 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.912 1.285 . . . . 0.0 112.506 -178.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -144.39 168.06 20.98 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.022 1.329 . . . . 0.0 111.495 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -123.26 134.82 54.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.237 1.015 . . . . 0.0 111.044 -174.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 127.393 2.277 . . . . 0.0 110.173 178.238 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 120.418 0.151 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.72 142.99 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.257 1.023 . . . . 0.0 111.231 170.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -133.98 167.43 20.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.071 1.348 . . . . 0.0 111.379 170.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.18 140.29 53.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.863 1.265 . . . . 0.0 110.161 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.66 147.37 51.42 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 124.282 1.033 . . . . 0.0 111.997 -171.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -86.98 120.94 28.77 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.055 0.942 . . . . 0.0 109.69 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -71.96 -9.86 58.96 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.23 1.012 . . . . 0.0 113.033 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mt -109.42 -62.4 2.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.127 1.371 . . . . 0.0 109.681 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.9 p -80.2 -8.67 59.55 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -171.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 60.14 1.06 0.32 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.917 2.087 . . . . 0.0 114.929 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.09 128.78 19.73 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.727 1.211 . . . . 0.0 109.318 169.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.9 m -133.53 132.36 40.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.871 0.869 . . . . 0.0 110.605 -169.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -151.64 152.11 32.39 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.61 1.164 . . . . 0.0 110.99 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -173.37 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 122.722 1.248 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -140.22 153.35 46.54 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.783 2.433 . . . . 0.0 109.587 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -100.79 144.42 29.78 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.263 1.025 . . . . 0.0 110.341 -176.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -142.81 166.38 24.79 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.399 1.88 . . . . 0.0 109.918 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -122.76 150.47 42.74 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.541 0.736 . . . . 0.0 111.718 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.2 m . . . . . 0 N--CA 1.467 0.383 0 C-N-CA 123.685 0.794 . . . . 0.0 111.474 173.026 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.0 ttt85 . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -103.34 133.82 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.27 171.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -126.55 165.24 19.52 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.454 1.901 . . . . 0.0 111.813 -177.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -115.3 135.38 54.21 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.802 0.841 . . . . 0.0 111.355 -172.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.61 151.39 50.27 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.557 1.543 . . . . 0.0 110.829 174.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -103.46 116.48 32.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.834 0.854 . . . . 0.0 111.099 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -71.03 -16.65 62.62 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.48 -0.762 . . . . 0.0 112.873 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 52.5 mt -94.11 -44.21 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.453 1.101 . . . . 0.0 110.826 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 p -106.93 -6.96 17.23 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.32 0.2 OUTLIER 53.04 17.27 0.88 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.897 2.079 . . . . 0.0 116.083 -170.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.7 160.18 32.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.324 0.65 . . . . 0.0 110.515 169.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.8 p -145.44 157.11 44.07 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.649 0.78 . . . . 0.0 111.936 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -152.74 146.68 25.3 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.498 1.119 . . . . 0.0 111.066 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.595 0 C-N-CA 122.783 0.433 . . . . 0.0 110.629 -172.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.1 tttp . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 118.05 -0.976 . . . . 0.0 108.533 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.452 HD12 ' H ' ' A' ' 30' ' ' SER . 48.8 mt -72.03 162.87 71.22 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 123.46 0.704 . . . . 0.0 111.556 172.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -53.54 136.91 65.38 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.436 2.757 . . . . 0.0 115.019 -169.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -86.23 -163.53 0.18 Allowed 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 125.059 3.84 . . . . 0.0 112.164 -179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.13 27.79 29.98 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 124.044 0.83 . . . . 0.0 114.14 174.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.453 ' CE2' ' HG3' ' A' ' 29' ' ' PRO . 73.0 m95 -101.3 160.57 14.3 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 113.869 1.063 . . . . 0.0 113.869 -176.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -136.8 157.09 47.55 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.834 2.053 . . . . 0.0 110.362 170.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.16 140.45 29.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 123.642 0.777 . . . . 0.0 111.628 169.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -132.39 161.13 34.39 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 127.324 2.25 . . . . 0.0 110.797 -174.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.43 138.2 43.04 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.74 1.616 . . . . 0.0 112.74 -178.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 88.2 p -137.64 87.01 2.23 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.97 1.708 . . . . 0.0 108.531 173.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 tpt85 -111.25 143.23 42.36 Favored 'General case' 0 N--CA 1.47 0.551 1 CA-C-N 68.331 -22.213 . . . . 0.0 111.631 169.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.7 t -95.05 143.21 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 124.976 1.31 . . . . 0.0 108.776 169.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 31.9 p90 -134.89 173.6 11.53 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.215 1.406 . . . . 0.0 110.79 171.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -121.3 137.1 54.84 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.639 1.175 . . . . 0.0 109.701 -176.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -138.38 147.36 43.32 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.308 1.043 . . . . 0.0 112.387 -176.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -93.73 116.92 29.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.123 0.569 . . . . 0.0 111.142 -177.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -68.29 -22.15 64.75 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.935 0.894 . . . . 0.0 112.519 -178.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -95.89 -40.67 11.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 124.501 1.12 . . . . 0.0 111.254 -178.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -107.87 -5.54 17.17 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.34 1.456 . . . . 0.0 113.467 -169.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.321 0.0 OUTLIER 59.79 -8.6 0.05 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 129.191 2.996 . . . . 0.0 118.103 -178.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.33 138.43 39.34 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.121 0.873 . . . . 0.0 111.758 173.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 94.1 p -140.2 128.47 22.5 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.763 1.225 . . . . 0.0 111.03 -170.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -152.77 151.95 31.07 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.023 0.929 . . . . 0.0 112.39 -172.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -73.11 -24.29 60.6 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -116.42 144.21 44.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.609 1.563 . . . . 0.0 110.08 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.0 ptm85 -83.66 150.21 59.01 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 -174.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.453 ' HG3' ' CE2' ' A' ' 6' ' ' TRP . 27.9 Cg_endo -72.97 -166.91 0.32 Allowed 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 124.212 3.275 . . . . 0.0 109.284 168.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.452 ' H ' HD12 ' A' ' 2' ' ' LEU . 0.0 OUTLIER -75.53 0.15 18.29 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 120.77 -1.206 . . . . 0.0 112.065 168.757 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.306 0 C-N-CA 128.578 2.99 . . . . 0.0 112.635 176.057 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.952 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -57.67 -32.63 13.78 Favored Pre-proline 0 CA--C 1.55 0.944 0 CA-C-O 117.193 -1.384 . . . . 0.0 114.112 173.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -52.98 163.85 1.91 Allowed 'Trans proline' 0 CA--C 1.55 1.324 0 C-N-CA 123.171 2.581 . . . . 0.0 115.543 171.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 99.3 Cg_exo -52.32 161.25 2.81 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 125.088 3.859 . . . . 0.0 117.313 -169.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 116.39 -1.22 20.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 125.054 1.311 . . . . 0.0 113.885 -171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -102.6 157.45 16.92 Favored 'General case' 0 C--N 1.338 0.066 0 C-N-CA 124.541 1.136 . . . . 0.0 114.039 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -141.48 166.41 24.83 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 127.962 2.505 . . . . 0.0 108.589 169.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -133.41 151.74 51.84 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.139 -0.976 . . . . 0.0 112.995 170.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.6 mmp_? -134.52 158.71 43.25 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 128.075 2.55 . . . . 0.0 110.858 -169.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.16 151.02 40.13 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.864 1.266 . . . . 0.0 112.605 174.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.3 t -140.3 53.48 1.64 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.048 1.739 . . . . 0.0 109.339 174.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.68 179.45 5.68 Favored 'General case' 0 CA--C 1.539 0.525 1 CA-C-N 63.723 -24.308 . . . . 0.0 112.284 169.869 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -140.86 149.12 21.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 127.055 2.142 . . . . 0.0 108.107 179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -143.04 162.04 36.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.644 0.778 . . . . 0.0 112.473 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -97.05 135.22 39.35 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.254 1.421 . . . . 0.0 111.097 177.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.06 140.9 51.95 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 125.505 1.522 . . . . 0.0 111.18 172.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -100.04 111.91 24.2 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 114.777 -1.101 . . . . 0.0 111.282 -169.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.64 -16.25 61.71 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.799 0.839 . . . . 0.0 111.912 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 43.5 mm -99.89 -45.35 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 124.425 1.09 . . . . 0.0 111.894 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 18.5 p -99.02 -8.65 25.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -174.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.316 0.0 OUTLIER 61.59 2.24 0.67 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.864 2.065 . . . . 0.0 115.615 -170.186 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.38 171.13 5.15 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-O 122.69 1.233 . . . . 0.0 112.54 174.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.9 m -155.98 148.39 23.69 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.667 -1.27 . . . . 0.0 111.227 175.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -157.75 150.66 23.04 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.173 0.989 . . . . 0.0 111.488 -173.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 55.3 m-85 -83.83 -36.04 23.77 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.054 0.542 . . . . 0.0 111.86 174.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -74.21 168.89 18.69 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.413 0.685 . . . . 0.0 109.645 169.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.09 134.23 32.03 Favored Pre-proline 0 CA--C 1.546 0.808 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -169.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . 0.286 18.1 Cg_exo 25.62 61.43 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 2 C-N-CA 126.904 5.069 . . . . 0.0 123.431 168.548 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.8 m -78.9 -35.1 44.11 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 168.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.484 0 C-N-CA 126.327 1.918 . . . . 0.0 112.888 169.236 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.3 pttm . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 118.348 -0.834 . . . . 0.0 109.061 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -138.67 172.41 6.65 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 125.506 1.522 . . . . 0.0 111.318 -177.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -58.61 176.13 0.47 Allowed 'Trans proline' 0 CA--C 1.551 1.335 0 C-N-CA 124.836 3.69 . . . . 0.0 115.078 177.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -59.81 177.82 0.44 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.872 3.715 . . . . 0.0 116.333 -178.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 98.52 37.45 4.26 Favored Glycine 0 CA--C 1.531 1.076 0 C-N-CA 124.515 1.055 . . . . 0.0 113.852 -178.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 86.3 m95 -82.02 168.15 18.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 116.576 2.065 . . . . 0.0 116.576 -169.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -151.78 157.99 42.71 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 130.334 3.454 . . . . 0.0 109.433 172.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -119.0 125.39 49.27 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.542 -0.724 . . . . 0.0 112.132 -169.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -128.43 162.11 27.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.891 1.276 . . . . 0.0 113.307 -169.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 62.3 mtt -119.77 152.1 37.77 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.803 1.241 . . . . 0.0 111.581 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.2 t -131.54 45.74 2.75 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 127.016 2.126 . . . . 0.0 109.769 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -127.15 160.73 30.33 Favored 'General case' 0 N--CA 1.468 0.442 1 CA-C-N 64.023 -24.171 . . . . 0.0 111.843 169.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.1 p -129.62 144.83 36.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 126.476 1.91 . . . . 0.0 108.686 174.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.2 p90 -148.7 168.32 23.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.126 0.97 . . . . 0.0 111.452 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -118.76 146.86 44.45 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.833 0.825 . . . . 0.0 109.532 -179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.31 153.17 51.24 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 121.076 -1.015 . . . . 0.0 110.101 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.5 t-20 -97.02 116.21 28.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.518 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -73.91 0.13 14.33 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.813 1.042 . . . . 0.0 113.813 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.1 mt -113.91 -61.73 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 21.0 p -81.62 -4.9 57.37 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 -175.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.305 20.2 m-80 60.23 3.05 0.49 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 128.148 2.579 . . . . 0.0 117.886 169.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.01 106.38 4.87 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.145 -0.972 . . . . 0.0 111.879 173.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.0 p -80.06 127.58 32.46 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.548 1.539 . . . . 0.0 111.013 169.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -159.9 162.87 34.62 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -169.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -87.35 -21.41 25.7 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 176.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -75.88 116.63 16.77 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.313 0.96 . . . . 0.0 110.94 172.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 3.7 ptm180 -113.67 145.61 33.76 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 125.504 1.522 . . . . 0.0 113.203 -170.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -72.54 -170.84 0.64 Allowed 'Trans proline' 0 CA--C 1.544 1.007 0 C-N-CA 124.972 3.781 . . . . 0.0 112.634 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 76.9 p -75.0 57.17 0.79 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.506 1.522 . . . . 0.0 112.937 172.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.046 1.308 . . . . 0.0 113.089 174.93 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.7 mttp . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 87.2 mt -142.9 174.83 3.29 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 128.311 2.644 . . . . 0.0 107.451 179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_exo -57.07 163.86 7.2 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 122.556 2.171 . . . . 0.0 113.116 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -62.53 178.44 0.93 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 123.918 3.079 . . . . 0.0 115.069 178.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 87.75 71.94 1.28 Allowed Glycine 0 CA--C 1.531 1.084 0 C-N-CA 124.309 0.956 . . . . 0.0 112.697 -176.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -126.55 166.87 16.48 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 125.186 1.395 . . . . 0.0 112.42 -174.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -143.45 161.15 39.15 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.689 1.995 . . . . 0.0 111.271 171.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.464 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -90.86 156.18 18.21 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 114.584 1.328 . . . . 0.0 114.584 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 84.1 mtt180 -143.68 168.22 20.42 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 126.957 2.103 . . . . 0.0 109.669 174.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 51.5 mtt -121.8 152.25 39.71 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.048 0.939 . . . . 0.0 111.197 170.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.1 t -135.34 40.16 2.85 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.5 1.12 . . . . 0.0 112.001 -175.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -120.82 151.2 39.9 Favored 'General case' 0 C--O 1.234 0.252 1 CA-C-N 67.581 -22.554 . . . . 0.0 113.298 168.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -93.97 148.31 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 126.445 1.898 . . . . 0.0 109.794 173.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -142.69 172.0 13.29 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.672 1.189 . . . . 0.0 110.891 170.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -123.11 142.19 51.15 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.074 0.95 . . . . 0.0 111.423 -169.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.88 141.98 50.34 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.656 1.182 . . . . 0.0 111.87 -174.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -82.63 119.26 24.05 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.052 -0.499 . . . . 0.0 110.298 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . 0.252 1.4 p80 -84.55 23.86 1.08 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 119.982 1.265 . . . . 0.0 113.297 -177.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.1 mt -126.76 -50.48 1.61 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 126.278 1.831 . . . . 0.0 109.788 172.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 3.4 m -92.42 -10.11 39.18 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.429 1.892 . . . . 0.0 112.816 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.272 68.8 m-20 57.6 -11.32 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 129.851 3.261 . . . . 0.0 117.921 -177.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.31 161.32 1.9 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.98 1.712 . . . . 0.0 111.446 169.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 m -152.73 150.43 29.41 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.657 -1.277 . . . . 0.0 113.058 -169.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -165.29 -174.57 3.27 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.372 1.469 . . . . 0.0 110.568 177.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -88.38 -16.25 33.45 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 176.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -73.23 154.32 40.28 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 175.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 42.8 ttt180 -122.97 125.33 26.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.429 1.491 . . . . 0.0 110.548 170.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_exo -74.06 -165.06 0.24 Allowed 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 123.972 3.115 . . . . 0.0 111.804 169.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.2 p -72.81 64.26 0.66 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.342 1.057 . . . . 0.0 110.252 169.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.324 0 C-N-CA 126.137 1.827 . . . . 0.0 112.039 -174.396 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.0 ptpp? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 94.4 mt -148.96 166.34 15.55 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 126.987 2.115 . . . . 0.0 109.705 -169.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.76 172.98 0.29 Allowed 'Trans proline' 0 CA--C 1.55 1.32 0 C-N-CA 124.915 3.743 . . . . 0.0 114.912 174.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -57.51 179.56 0.13 Allowed 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 125.014 3.809 . . . . 0.0 117.101 -173.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 100.1 12.81 38.43 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.77 1.176 . . . . 0.0 114.225 -174.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -75.0 154.73 37.94 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -170.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -144.2 163.55 33.31 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 129.96 3.304 . . . . 0.0 109.293 175.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.3 mttt -115.31 151.87 33.79 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.2 1.0 . . . . 0.0 110.993 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.0 mmt-85 -147.72 162.66 38.74 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 126.089 1.756 . . . . 0.0 111.509 -172.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 97.5 mmm -116.92 147.79 41.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.66 1.184 . . . . 0.0 111.313 -178.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.9 t -128.62 45.15 2.83 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.49 1.916 . . . . 0.0 109.832 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 63.3 mtm180 -119.43 160.64 21.94 Favored 'General case' 0 N--CA 1.467 0.381 1 CA-C-N 64.551 -23.931 . . . . 0.0 112.637 169.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 9.3 p -121.56 144.8 29.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 126.831 2.052 . . . . 0.0 108.898 169.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -146.05 167.38 23.5 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.573 1.149 . . . . 0.0 111.375 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -114.21 146.94 39.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.663 0.785 . . . . 0.0 109.839 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -136.27 153.54 51.15 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 125.678 1.591 . . . . 0.0 110.758 176.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -109.05 121.35 44.95 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -177.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -69.67 -23.01 63.4 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.913 0.885 . . . . 0.0 112.999 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 55.3 mt -97.41 -59.62 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 125.32 1.448 . . . . 0.0 110.217 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 30.6 p -79.1 -11.1 59.98 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -176.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.351 49.5 m-80 52.81 40.54 30.8 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.897 2.079 . . . . 0.0 115.219 170.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -121.25 168.4 11.65 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.403 1.881 . . . . 0.0 109.357 169.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 91.4 p -141.96 162.06 36.42 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.436 1.095 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -168.07 161.89 12.84 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.935 1.294 . . . . 0.0 111.429 170.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -82.26 -21.84 36.05 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.308 1.043 . . . . 0.0 112.845 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -87.62 144.99 26.39 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.047 0.939 . . . . 0.0 109.746 171.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 41.9 ptt85 -109.23 148.98 39.1 Favored Pre-proline 0 CA--C 1.543 0.679 0 N-CA-C 115.958 1.836 . . . . 0.0 115.958 -168.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -68.98 48.55 0.5 Allowed 'Trans proline' 0 CA--C 1.548 1.219 1 C-N-CA 126.021 4.481 . . . . 0.0 113.099 170.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 52.4 p 59.4 -17.0 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 118.872 2.915 . . . . 0.0 118.872 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.073 0 C-N-CA 126.053 1.787 . . . . 0.0 114.604 169.914 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.9 mttp . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 116.828 -1.558 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 21.7 tp -129.33 94.86 31.97 Favored Pre-proline 0 CA--C 1.545 0.758 0 CA-C-N 120.735 1.607 . . . . 0.0 112.481 -169.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -64.56 -28.52 61.4 Favored 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 124.099 3.2 . . . . 0.0 116.523 171.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_exo -66.21 153.66 77.2 Favored 'Trans proline' 0 C--N 1.354 0.825 0 C-N-CA 123.627 2.885 . . . . 0.0 113.828 169.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 88.07 7.95 72.96 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 123.911 0.767 . . . . 0.0 114.555 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.421 ' HB2' ' CE2' ' A' ' 16' ' ' TYR . 22.8 m95 -122.71 152.57 40.44 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.511 1.125 . . . . 0.0 112.462 -178.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -106.99 150.59 26.33 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 125.628 1.571 . . . . 0.0 111.31 171.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.9 115.2 25.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 126.788 2.035 . . . . 0.0 107.437 -169.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -134.29 163.0 30.63 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.691 1.196 . . . . 0.0 112.947 -169.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.14 147.68 51.05 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.771 1.228 . . . . 0.0 112.522 172.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.4 t -137.07 51.83 1.95 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.972 2.109 . . . . 0.0 109.154 176.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.21 175.55 8.83 Favored 'General case' 0 CA--C 1.537 0.446 1 CA-C-N 64.161 -24.108 . . . . 0.0 112.342 169.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.5 t -116.97 150.53 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 127.177 2.191 . . . . 0.0 107.662 169.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -142.74 166.69 23.97 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 122.359 1.076 . . . . 0.0 113.293 173.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.421 ' CE2' ' HB2' ' A' ' 6' ' ' TRP . 1.2 t80 -120.19 131.99 55.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 127.511 2.325 . . . . 0.0 108.834 -176.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.26 139.53 46.98 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.454 1.101 . . . . 0.0 112.784 176.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -86.24 123.53 31.61 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.936 0.494 . . . . 0.0 111.351 -174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.21 2.99 22.16 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -175.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.8 mt -114.68 -49.54 5.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 C-N-CA 125.482 1.513 . . . . 0.0 110.143 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 4.7 m -93.31 -15.81 25.38 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 125.439 1.496 . . . . 0.0 113.013 -174.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 58.88 20.11 7.73 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.645 1.578 . . . . 0.0 114.532 -173.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -69.8 152.76 44.21 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.381 -0.824 . . . . 0.0 109.717 169.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.0 p -146.31 132.48 19.4 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.296 0.638 . . . . 0.0 112.152 -175.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -155.41 161.55 40.98 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.301 1.44 . . . . 0.0 110.834 -178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -72.42 -36.61 68.66 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 -170.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -116.84 176.53 5.08 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.414 1.085 . . . . 0.0 109.106 171.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 27.8 mtm180 -59.09 158.13 19.05 Favored Pre-proline 0 N--CA 1.474 0.763 0 C-N-CA 125.048 1.339 . . . . 0.0 111.653 177.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -73.75 60.53 4.41 Favored 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 123.265 2.643 . . . . 0.0 110.783 169.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 71.0 m -60.43 -38.61 84.65 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 111.871 -174.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 C-N-CA 125.686 1.612 . . . . 0.0 112.127 179.26 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.1 pttm . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 118.744 -0.646 . . . . 0.0 109.313 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 55.6 mt -146.9 179.36 1.18 Allowed Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 126.066 1.746 . . . . 0.0 111.335 -169.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -61.71 178.9 0.6 Allowed 'Trans proline' 0 CA--C 1.554 1.509 0 C-N-CA 124.356 3.371 . . . . 0.0 115.253 175.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -64.58 -177.35 0.52 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.832 3.688 . . . . 0.0 116.485 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.49 88.61 0.55 Allowed Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.205 1.859 . . . . 0.0 113.21 177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 83.1 m95 -136.93 161.48 35.92 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 -169.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -134.85 133.69 39.98 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.925 2.09 . . . . 0.0 107.695 168.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.98 130.23 38.62 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 169.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -137.8 163.65 30.86 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 124.888 1.275 . . . . 0.0 112.016 -169.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 27.6 ptm -74.34 146.57 42.97 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.613 0.765 . . . . 0.0 112.585 178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 t -132.92 44.82 2.81 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.427 1.891 . . . . 0.0 109.898 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 67.5 mtp85 -121.81 172.83 7.88 Favored 'General case' 0 N--CA 1.469 0.481 1 CA-C-N 63.71 -24.314 . . . . 0.0 111.602 169.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 14.0 p -122.48 147.71 26.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 126.507 1.923 . . . . 0.0 107.644 169.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -141.55 171.21 14.37 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.098 0.959 . . . . 0.0 112.105 -178.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -116.27 130.21 56.67 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.07 1.748 . . . . 0.0 109.909 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -125.19 144.71 50.31 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.694 0.759 . . . . 0.0 111.542 169.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -88.91 118.85 28.92 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.87 -175.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -68.47 -22.81 64.54 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 120.536 -1.353 . . . . 0.0 112.878 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 39.1 mm -94.85 -56.53 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.312 1.045 . . . . 0.0 110.641 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.5 m -74.77 -19.31 60.26 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.602 1.561 . . . . 0.0 111.908 -176.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.355 17.1 m-80 59.76 5.02 0.63 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 128.434 2.694 . . . . 0.0 116.317 179.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.96 155.2 40.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.89 1.276 . . . . 0.0 111.191 169.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 73.5 m -130.73 138.44 49.98 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 125.451 1.5 . . . . 0.0 110.758 -173.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.09 166.82 31.52 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.396 1.078 . . . . 0.0 112.059 -173.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -95.64 -15.64 22.59 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 170.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -74.26 175.28 7.74 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-O 121.85 0.833 . . . . 0.0 112.193 170.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 31.4 mtm105 -94.49 179.58 1.18 Allowed Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 125.17 1.388 . . . . 0.0 109.55 168.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_endo -54.18 172.64 0.28 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.734 2.956 . . . . 0.0 112.764 168.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 34.8 t -71.19 37.78 0.05 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.509 1.523 . . . . 0.0 114.101 177.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.08 0 C-N-CA 127.884 2.659 . . . . 0.0 109.839 -178.171 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 pttp . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 119.612 -0.233 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 50.0 tp -116.97 -32.78 0.08 OUTLIER Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 125.855 1.662 . . . . 0.0 114.135 173.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -64.04 172.06 6.66 Favored 'Trans proline' 0 CA--C 1.55 1.294 0 C-N-CA 122.896 2.397 . . . . 0.0 114.662 176.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -63.77 -169.75 0.11 Allowed 'Trans proline' 0 CA--C 1.545 1.061 1 C-N-CA 125.806 4.338 . . . . 0.0 117.138 -176.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.55 -103.82 2.98 Favored Glycine 0 C--N 1.342 0.896 0 N-CA-C 107.419 -2.273 . . . . 0.0 107.419 -169.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -71.04 153.06 42.91 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 117.655 0.727 . . . . 0.0 110.641 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -135.4 151.78 50.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.873 2.069 . . . . 0.0 110.754 176.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.1 mttm -97.3 136.37 37.89 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.85 1.26 . . . . 0.0 109.879 179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -133.3 165.79 24.0 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.813 2.445 . . . . 0.0 109.952 -173.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 15.8 mmt -121.67 142.14 50.45 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.632 0.73 . . . . 0.0 112.402 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.3 p -130.53 73.07 1.52 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.355 2.262 . . . . 0.0 108.362 176.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -113.8 125.22 53.84 Favored 'General case' 0 N--CA 1.471 0.584 1 CA-C-N 67.096 -22.775 . . . . 0.0 110.492 169.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.1 p -75.73 144.56 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.313 1.045 . . . . 0.0 111.022 174.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 8.8 p90 -135.72 166.33 23.51 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.321 0.582 . . . . 0.0 111.011 169.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -128.38 138.72 52.48 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.927 1.291 . . . . 0.0 109.551 -172.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -135.03 148.73 49.99 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 124.164 0.986 . . . . 0.0 111.175 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -96.16 117.4 30.65 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.873 178.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -67.42 -15.76 63.85 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.46 -0.775 . . . . 0.0 112.424 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.34 -43.13 15.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 C-N-CA 123.74 0.816 . . . . 0.0 111.849 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 36.4 p -123.51 -1.57 8.54 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -173.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.83 6.62 0.93 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.399 1.879 . . . . 0.0 115.134 -172.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.99 126.31 20.06 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.202 -0.936 . . . . 0.0 108.568 169.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.4 m -139.5 136.03 34.12 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.512 0.725 . . . . 0.0 111.41 -169.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -161.08 163.91 31.13 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.573 1.149 . . . . 0.0 111.676 -173.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -73.26 -49.65 26.59 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.584 0.957 . . . . 0.0 113.584 -177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -81.77 168.83 17.62 Favored 'General case' 0 N--CA 1.465 0.325 0 N-CA-C 113.92 1.081 . . . . 0.0 113.92 174.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 6.8 ptp180 -111.43 162.28 21.67 Favored Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 119.469 3.137 . . . . 0.0 119.469 -167.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.94 -142.82 0.02 OUTLIER 'Trans proline' 0 CA--C 1.547 1.126 1 C-N-CA 125.655 4.237 . . . . 0.0 107.671 167.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.2 t -64.38 48.15 0.02 OUTLIER 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 126.264 1.825 . . . . 0.0 115.443 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.237 0 C-N-CA 127.149 2.309 . . . . 0.0 115.509 170.357 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm . . . . . 0 N--CA 1.483 1.181 0 CA-C-O 118.458 -0.782 . . . . 0.0 112.215 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -72.45 160.27 83.21 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 123.941 0.896 . . . . 0.0 112.227 -176.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -64.66 154.18 73.66 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 123.589 2.859 . . . . 0.0 114.939 -171.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -65.32 174.61 4.91 Favored 'Trans proline' 0 C--N 1.354 0.828 0 C-N-CA 124.747 3.631 . . . . 0.0 116.368 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 112.56 41.59 1.02 Allowed Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.597 1.57 . . . . 0.0 111.994 -171.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 41.8 m95 -78.44 170.82 16.03 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 117.634 2.457 . . . . 0.0 117.634 -168.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -146.14 144.23 29.83 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 130.744 3.618 . . . . 0.0 106.622 169.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.09 126.23 36.11 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 123.866 0.866 . . . . 0.0 111.503 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 25.6 mmt85 -136.6 166.46 23.48 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.713 1.205 . . . . 0.0 111.51 -173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.5 mpp? -112.51 140.49 47.21 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.79 0.836 . . . . 0.0 111.165 -174.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 80.5 p -138.33 89.15 2.36 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 126.544 1.938 . . . . 0.0 108.752 -176.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.67 162.72 18.53 Favored 'General case' 0 N--CA 1.472 0.667 1 CA-C-N 69.635 -21.62 . . . . 0.0 113.852 169.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 38.8 t -101.16 141.99 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.507 1.523 . . . . 0.0 107.838 169.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -136.97 169.62 17.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.525 1.53 . . . . 0.0 111.492 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 4.8 m-30 -110.49 128.13 55.48 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.416 0.687 . . . . 0.0 110.29 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -112.74 143.98 43.04 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.883 0.873 . . . . 0.0 109.651 169.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.0 t-20 -88.19 116.85 26.68 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 122.276 -0.265 . . . . 0.0 110.594 -175.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -77.49 0.46 22.68 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -177.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.6 mt -117.22 -48.84 4.17 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.527 1.931 . . . . 0.0 110.287 176.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.87 -5.36 38.38 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.698 1.599 . . . . 0.0 113.5 -172.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.299 0.2 OUTLIER 52.86 19.44 1.31 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.866 2.066 . . . . 0.0 116.325 -174.174 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -70.36 173.48 6.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.983 1.313 . . . . 0.0 112.112 171.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 m -153.1 135.69 15.2 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.556 -1.34 . . . . 0.0 111.209 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -145.58 147.04 31.65 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 124.506 1.122 . . . . 0.0 113.586 -169.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -93.85 -14.99 25.49 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.99 1.316 . . . . 0.0 112.088 169.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -82.58 -5.22 58.66 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.947 1.699 . . . . 0.0 115.342 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.27 0.0 OUTLIER 34.46 63.46 1.87 Allowed Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 128.256 2.622 . . . . 0.0 113.145 -170.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -60.96 127.11 21.33 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 123.367 2.711 . . . . 0.0 115.737 -169.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.0 t 48.01 6.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 120.368 3.47 . . . . 0.0 120.368 169.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.972 0 CA-C-O 118.097 -1.391 . . . . 0.0 111.45 172.057 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 6.2 tmtm? . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.93 152.27 84.54 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.404 178.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_exo -52.9 -33.85 63.56 Favored 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 123.894 3.063 . . . . 0.0 119.757 -169.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -47.02 151.97 2.05 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 123.991 3.127 . . . . 0.0 115.876 -170.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -53.07 -15.2 3.34 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -168.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.422 ' HE1' ' HB3' ' A' ' 16' ' ' TYR . 1.1 t-105 -117.2 172.64 7.16 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.691 2.245 . . . . 0.0 113.837 -177.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -164.88 170.92 14.76 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.821 2.449 . . . . 0.0 112.144 -169.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.07 140.85 51.72 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.226 1.41 . . . . 0.0 112.856 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -141.58 169.73 17.05 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 126.842 2.057 . . . . 0.0 111.254 -169.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -120.99 145.23 47.97 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.46 1.104 . . . . 0.0 110.458 178.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 34.9 t -126.57 38.18 4.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 126.146 1.779 . . . . 0.0 111.428 -177.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mmm-85 -138.17 157.82 45.53 Favored 'General case' 0 N--CA 1.467 0.402 1 CA-C-N 68.67 -22.059 . . . . 0.0 113.62 169.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 44.0 t -93.76 145.04 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.971 1.709 . . . . 0.0 109.356 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 20.4 p90 -137.36 167.79 20.91 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.902 1.281 . . . . 0.0 110.679 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.422 ' HB3' ' HE1' ' A' ' 6' ' ' TRP . 27.2 m-85 -129.65 139.93 51.28 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.578 0.751 . . . . 0.0 109.858 -175.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -145.24 151.16 37.94 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -170.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -78.94 120.73 23.96 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.825 1.65 . . . . 0.0 110.426 173.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -81.21 7.6 10.89 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 114.538 1.311 . . . . 0.0 114.538 -176.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.9 mt -124.15 -45.47 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 126.271 1.828 . . . . 0.0 110.18 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.9 m -105.14 -4.16 22.16 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.33 1.852 . . . . 0.0 112.978 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.296 0.2 OUTLIER 54.49 6.58 0.11 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.578 2.351 . . . . 0.0 117.245 -176.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.65 122.98 10.03 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 169.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 50.2 m -131.11 136.35 48.3 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.378 1.071 . . . . 0.0 110.791 -169.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -139.23 143.62 38.1 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.357 1.063 . . . . 0.0 113.299 -171.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 -101.34 -14.19 17.71 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.684 1.594 . . . . 0.0 110.517 169.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -80.92 -6.05 58.2 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 127.894 2.477 . . . . 0.0 114.127 173.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.358 0.0 OUTLIER 60.81 151.27 0.1 OUTLIER Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 131.105 3.762 . . . . 0.0 114.009 -169.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -22.94 141.61 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.965 1 C-N-CA 130.284 7.323 . . . . 0.0 118.958 -172.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.4 p -55.55 87.63 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.817 2.047 . . . . 0.0 113.255 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 C-N-CA 130.074 3.702 . . . . 0.0 106.894 -174.044 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 118.872 -0.585 . . . . 0.0 110.169 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 34.4 mt -83.06 160.92 59.31 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.268 1.027 . . . . 0.0 110.796 169.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -67.13 156.71 65.1 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 123.303 2.669 . . . . 0.0 113.362 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -79.04 170.49 17.76 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 124.242 3.294 . . . . 0.0 112.419 175.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.14 87.28 0.26 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.435 1.017 . . . . 0.0 114.197 171.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 55.8 m95 -122.12 163.51 19.37 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.285 1.034 . . . . 0.0 113.456 -176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.21 155.98 44.11 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.984 2.114 . . . . 0.0 110.093 174.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HE2' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -84.2 152.97 23.91 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.384 0.674 . . . . 0.0 111.221 169.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -144.0 168.2 20.54 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.26 2.224 . . . . 0.0 109.09 -177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.1 tpt -118.76 158.41 25.63 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.987 0.898 . . . . 0.0 111.993 177.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.2 m -160.18 110.95 1.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 124.925 1.29 . . . . 0.0 110.455 172.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 7.7 tpt85 -107.96 139.06 43.15 Favored 'General case' 0 N--CA 1.469 0.497 1 CA-C-N 69.683 -21.599 . . . . 0.0 112.579 174.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.2 p -85.29 141.84 14.01 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.445 1.098 . . . . 0.0 108.914 169.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 6.0 p90 -134.53 169.65 16.95 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.311 1.044 . . . . 0.0 111.051 173.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -118.65 136.99 53.6 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.159 1.384 . . . . 0.0 110.815 -177.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -137.53 144.96 42.39 Favored 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 123.813 0.845 . . . . 0.0 112.689 -173.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -85.24 116.71 23.75 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.151 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -83.36 20.0 1.41 Allowed 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.8 mt -124.53 -44.8 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 126.276 1.831 . . . . 0.0 110.243 171.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 1.1 m -104.22 -12.77 16.48 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 126.584 1.954 . . . . 0.0 113.167 -169.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.324 0.0 OUTLIER 61.02 -4.17 0.14 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 128.191 2.596 . . . . 0.0 116.984 -170.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -43.77 121.95 2.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.143 1.377 . . . . 0.0 109.626 169.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 69.1 m -130.13 135.44 48.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 124.407 1.083 . . . . 0.0 111.42 -169.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -157.45 156.76 32.71 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.197 1.399 . . . . 0.0 110.549 -173.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -66.71 -32.22 73.39 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.53 -1.356 . . . . 0.0 114.064 -176.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -120.99 174.17 6.79 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.79 1.236 . . . . 0.0 112.29 -179.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 4.7 mtm-85 -69.7 156.12 92.28 Favored Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 124.788 1.235 . . . . 0.0 112.412 -176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -56.27 149.19 56.48 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.277 2.652 . . . . 0.0 113.199 170.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 94.4 p -78.56 18.75 0.54 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.74 1.616 . . . . 0.0 114.176 173.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.014 0 C-N-CA 126.238 1.875 . . . . 0.0 112.416 -171.079 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 118.235 -0.888 . . . . 0.0 109.131 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 17.0 mt -154.88 163.25 25.06 Favored Pre-proline 0 CA--C 1.548 0.868 0 C-N-CA 125.787 1.635 . . . . 0.0 111.11 -178.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -56.51 168.4 2.21 Favored 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 124.805 3.67 . . . . 0.0 115.376 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -54.8 162.73 4.67 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.708 3.605 . . . . 0.0 115.989 -175.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 89.64 95.42 1.12 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 109.541 -1.424 . . . . 0.0 109.541 -169.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 48.3 m95 -144.41 166.7 24.35 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.454 1.501 . . . . 0.0 111.113 -173.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -137.01 152.25 49.9 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.513 1.525 . . . . 0.0 110.325 173.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -105.66 127.52 53.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.679 1.591 . . . . 0.0 107.981 -178.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -141.71 170.26 16.04 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.005 0.922 . . . . 0.0 112.285 -169.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 4.6 tpt -107.11 156.76 18.45 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 0.0 111.403 172.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.7 p -147.73 84.51 1.54 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 126.283 1.833 . . . . 0.0 109.152 178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.6 164.62 22.47 Favored 'General case' 0 N--CA 1.47 0.56 1 CA-C-N 68.208 -22.269 . . . . 0.0 113.114 172.822 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.4 p -96.36 147.5 6.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 126.134 1.773 . . . . 0.0 108.957 169.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -140.75 163.87 31.73 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.633 0.73 . . . . 0.0 112.695 174.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -123.72 133.52 53.85 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.338 1.055 . . . . 0.0 110.208 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.88 146.54 42.86 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 121.008 -1.058 . . . . 0.0 111.298 177.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.36 121.81 24.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.013 -0.539 . . . . 0.0 109.736 174.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -77.77 -11.68 59.9 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -171.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 29.9 mm -99.9 -46.32 11.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 C-N-CA 125.505 1.522 . . . . 0.0 110.649 173.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.7 -8.01 26.87 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.299 1.04 . . . . 0.0 113.644 -169.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.298 0.0 OUTLIER 60.81 -12.33 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 129.338 3.055 . . . . 0.0 118.002 -176.623 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.97 111.46 0.56 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.492 1.117 . . . . 0.0 111.008 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 m -96.29 122.62 39.35 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 125.758 1.623 . . . . 0.0 108.792 -171.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -151.74 168.19 25.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 114.425 1.269 . . . . 0.0 114.425 -168.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -92.0 -17.22 25.4 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.574 0.75 . . . . 0.0 112.945 173.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -69.96 151.39 45.66 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.056 0.389 . . . . 0.0 110.114 169.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 13.1 mtm105 -138.57 151.29 68.65 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 118.834 -0.603 . . . . 0.0 112.064 -169.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -78.1 -170.8 1.04 Allowed 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 123.96 3.107 . . . . 0.0 109.657 169.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 90.5 p -70.63 72.16 0.51 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.708 1.203 . . . . 0.0 112.296 174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.75 1.643 . . . . 0.0 112.075 177.585 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.6 mttm . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 7.2 mp -73.65 160.69 81.58 Favored Pre-proline 0 CA--C 1.553 1.065 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -170.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -70.85 159.58 52.14 Favored 'Trans proline' 0 CA--C 1.546 1.102 0 C-N-CA 123.963 3.109 . . . . 0.0 115.238 -169.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.55 163.78 33.52 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 124.906 3.737 . . . . 0.0 114.849 -176.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.05 50.89 0.66 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 125.595 1.569 . . . . 0.0 111.174 -169.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -83.66 165.06 19.28 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 117.913 2.56 . . . . 0.0 117.913 -169.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -156.97 157.53 34.91 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 129.971 3.309 . . . . 0.0 108.62 169.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.31 134.84 48.83 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.516 1.127 . . . . 0.0 112.405 -175.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mmt-85 -137.86 161.99 35.16 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.47 1.508 . . . . 0.0 111.902 -169.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 26.7 ptm -87.31 141.91 28.29 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.129 0.972 . . . . 0.0 112.967 -176.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.8 t -129.46 46.56 2.62 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.951 2.1 . . . . 0.0 109.654 176.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -130.4 168.09 17.53 Favored 'General case' 0 CA--C 1.537 0.447 1 CA-C-N 64.323 -24.035 . . . . 0.0 111.82 169.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -112.37 148.33 15.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.701 2.0 . . . . 0.0 108.209 169.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -136.28 169.6 17.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.24 1.016 . . . . 0.0 111.905 174.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -112.73 130.13 56.17 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.619 1.568 . . . . 0.0 110.391 -176.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -130.33 146.56 51.94 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.43 1.092 . . . . 0.0 111.177 -177.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -87.92 116.82 26.36 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.089 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -77.18 -0.09 23.75 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 30.8 mt -106.69 -45.2 7.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 125.775 1.63 . . . . 0.0 110.342 176.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 13.0 t -126.89 12.37 7.26 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 115.424 1.639 . . . . 0.0 115.424 -171.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.293 0.0 OUTLIER 61.61 -10.2 0.07 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 128.78 2.832 . . . . 0.0 118.0 176.701 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -42.32 122.37 2.19 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.785 1.634 . . . . 0.0 110.473 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 60.0 m -128.93 135.05 48.5 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.358 1.063 . . . . 0.0 112.926 -169.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -156.38 168.22 28.02 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.482 1.513 . . . . 0.0 111.039 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -80.18 -14.37 58.51 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.559 -1.338 . . . . 0.0 113.488 171.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -96.84 158.7 15.31 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -171.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.34 149.89 36.45 Favored Pre-proline 0 CA--C 1.55 0.971 0 C-N-CA 125.121 1.368 . . . . 0.0 109.648 168.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -59.97 110.19 0.72 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.654 2.902 . . . . 0.0 111.961 -174.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 28.0 t -158.92 46.84 0.31 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.869 1.668 . . . . 0.0 110.077 -170.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.193 0 CA-C-O 117.619 -1.656 . . . . 0.0 110.17 -169.649 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.41 ' HA ' ' CE ' ' A' ' 1' ' ' LYS . 6.0 mmmt . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 5.6 tt -146.95 111.93 4.14 Favored Pre-proline 0 CA--C 1.544 0.736 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 169.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -80.98 148.87 17.41 Favored 'Trans proline' 0 CA--C 1.543 0.953 0 C-N-CA 122.661 2.24 . . . . 0.0 112.686 -174.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -69.83 167.88 23.24 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 123.323 2.682 . . . . 0.0 112.274 176.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.64 65.8 Favored Glycine 0 CA--C 1.534 1.22 0 CA-C-O 119.014 -0.881 . . . . 0.0 114.933 176.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -122.07 162.43 21.23 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.746 1.273 . . . . 0.0 112.849 178.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -146.42 156.33 43.22 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.39 1.876 . . . . 0.0 110.929 -177.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.22 143.3 29.64 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.912 1.285 . . . . 0.0 112.506 -178.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 17.4 mmt85 -144.39 168.06 20.98 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.022 1.329 . . . . 0.0 111.495 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -123.26 134.82 54.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.237 1.015 . . . . 0.0 111.044 -174.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 29.0 t -113.61 42.97 1.87 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 127.393 2.277 . . . . 0.0 110.173 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.26 135.14 54.46 Favored 'General case' 0 N--CA 1.47 0.542 1 CA-C-N 66.558 -23.019 . . . . 0.0 111.317 169.849 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.72 142.99 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.257 1.023 . . . . 0.0 111.231 170.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -133.98 167.43 20.61 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 125.071 1.348 . . . . 0.0 111.379 170.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -124.18 140.29 53.1 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.863 1.265 . . . . 0.0 110.161 -176.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -133.66 147.37 51.42 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 124.282 1.033 . . . . 0.0 111.997 -171.199 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -86.98 120.94 28.77 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.055 0.942 . . . . 0.0 109.69 179.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -71.96 -9.86 58.96 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.23 1.012 . . . . 0.0 113.033 -173.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mt -109.42 -62.4 2.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 125.127 1.371 . . . . 0.0 109.681 174.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.9 p -80.2 -8.67 59.55 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 -171.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 60.14 1.06 0.32 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.917 2.087 . . . . 0.0 114.929 -176.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.09 128.78 19.73 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.727 1.211 . . . . 0.0 109.318 169.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.9 m -133.53 132.36 40.85 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.871 0.869 . . . . 0.0 110.605 -169.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -151.64 152.11 32.39 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.61 1.164 . . . . 0.0 110.99 -172.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -66.11 -40.28 90.61 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -173.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -108.38 145.61 34.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.083 177.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -69.63 158.1 87.87 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -56.69 138.37 84.84 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.239 1.959 . . . . 0.0 109.858 168.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 85.9 p -90.43 -0.4 57.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 -172.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.142 0 C-N-CA 126.684 2.087 . . . . 0.0 114.65 -170.839 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.9 mmtm . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 119.059 -0.496 . . . . 0.0 110.235 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -85.48 -31.29 0.44 Allowed Pre-proline 0 CA--C 1.549 0.913 0 CA-C-O 116.584 -1.675 . . . . 0.0 114.797 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -60.16 -22.43 70.03 Favored 'Trans proline' 0 CA--C 1.55 1.285 0 N-CA-C 118.87 2.604 . . . . 0.0 118.87 179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -59.52 161.93 16.24 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 122.564 2.176 . . . . 0.0 113.386 172.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -69.34 68.49 0.52 Allowed Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.656 1.122 . . . . 0.0 113.651 -178.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -75.04 156.72 35.87 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.722 1.248 . . . . 0.0 112.917 174.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -140.22 153.35 46.54 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 127.783 2.433 . . . . 0.0 109.587 173.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -100.79 144.42 29.78 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.263 1.025 . . . . 0.0 110.341 -176.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 89.9 mmt-85 -142.81 166.38 24.79 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.399 1.88 . . . . 0.0 109.918 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -122.76 150.47 42.74 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.541 0.736 . . . . 0.0 111.718 -175.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.2 m -159.65 125.05 4.13 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.685 0.794 . . . . 0.0 111.474 173.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CFD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.0 ttt85 -117.98 154.95 31.11 Favored 'General case' 0 N--CA 1.472 0.646 1 CA-C-N 68.864 -21.971 . . . . 0.0 113.246 -176.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.1 p -103.34 133.82 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 C-N-CA 125.359 1.463 . . . . 0.0 110.27 171.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 4.6 p90 -126.55 165.24 19.52 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.454 1.901 . . . . 0.0 111.813 -177.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -115.3 135.38 54.21 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.802 0.841 . . . . 0.0 111.355 -172.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -129.61 151.39 50.27 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.557 1.543 . . . . 0.0 110.829 174.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -103.46 116.48 32.48 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.834 0.854 . . . . 0.0 111.099 -171.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -71.03 -16.65 62.62 Favored 'General case' 0 CA--C 1.541 0.633 0 O-C-N 121.48 -0.762 . . . . 0.0 112.873 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 52.5 mt -94.11 -44.21 13.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.453 1.101 . . . . 0.0 110.826 179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 23.9 p -106.93 -6.96 17.23 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.522 1.305 . . . . 0.0 114.522 -172.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . 0.32 0.2 OUTLIER 53.04 17.27 0.88 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.897 2.079 . . . . 0.0 116.083 -170.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -72.7 160.18 32.64 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.324 0.65 . . . . 0.0 110.515 169.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.8 p -145.44 157.11 44.07 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.649 0.78 . . . . 0.0 111.936 174.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -152.74 146.68 25.3 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.498 1.119 . . . . 0.0 111.066 178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -44.99 77.15 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.783 0.433 . . . . 0.0 110.629 -172.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -96.96 143.84 27.44 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.183 0.993 . . . . 0.0 110.541 169.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.515 ' H ' ' NE ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -61.24 153.2 69.11 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 125.218 1.407 . . . . 0.0 110.916 169.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -53.29 136.3 62.25 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 121.86 1.707 . . . . 0.0 112.965 172.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 p -78.36 -9.25 59.19 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.795 1.238 . . . . 0.0 113.828 174.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.139 0 C-N-CA 127.953 2.692 . . . . 0.0 110.052 179.304 . . . . . . . . 0 0 . 1 stop_ save_