data_2lwq_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 2lwq _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.865 0.364 . . . . 72.25 110.87 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.2 p90 -153.6 153.17 28.65 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.576 0.703 . . . . 74.15 110.945 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 154.24 67.97 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.702 2.268 . . . . 74.51 112.343 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.12 149.63 64.33 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.591 0.71 . . . . 75.2 111.097 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 50.06 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.719 2.279 . . . . 72.12 112.276 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.01 151.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.71 0.767 . . . . 73.21 110.854 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.466 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.4 Cg_endo -69.86 131.92 22.08 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.69 2.26 . . . . 74.41 112.281 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.466 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.1 Cg_endo -69.68 133.33 25.11 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.688 -1.797 . . . . 71.22 112.356 -0.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.86 -18.87 47.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 75.33 110.883 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -120.7 124.11 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.886 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t0 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 75.11 110.817 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.782 0.325 . . . . 52.43 110.904 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -152.56 153.14 30.09 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.524 0.678 . . . . 73.21 110.994 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.82 153.71 68.33 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.66 2.24 . . . . 64.3 112.303 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.67 149.6 65.34 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 72.31 111.153 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 50.02 0.76 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.686 2.258 . . . . 73.45 112.352 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.96 151.94 0.23 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.697 0.761 . . . . 73.41 110.925 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.435 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.71 131.89 22.26 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.222 . . . . 61.23 112.392 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.435 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.7 Cg_endo -69.77 133.29 25.1 Favored 'Cis proline' 0 C--O 1.231 0.138 0 C-N-CA 122.656 -1.81 . . . . 74.11 112.322 -0.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -59.82 -18.81 46.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.901 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -120.83 124.0 43.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.905 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 t0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 73.3 110.83 179.981 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.738 0.304 . . . . 72.35 110.933 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -154.61 153.1 27.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.51 0.671 . . . . 75.42 110.917 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 153.73 68.45 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.65 2.233 . . . . 72.45 112.283 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -137.21 149.78 67.02 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.635 0.731 . . . . 71.14 111.103 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 50.01 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.654 2.236 . . . . 54.31 112.356 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.98 151.96 0.23 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.621 0.724 . . . . 62.5 110.976 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.0 Cg_endo -69.77 131.84 22.06 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.655 2.237 . . . . 74.41 112.317 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.444 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.7 Cg_endo -69.83 133.33 25.34 Favored 'Cis proline' 0 C--N 1.342 0.224 0 C-N-CA 122.667 -1.806 . . . . 72.45 112.307 -0.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -59.79 -18.9 47.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.891 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -120.54 123.41 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 75.54 110.912 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.133 -0.485 . . . . 64.1 110.927 179.939 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.4 m . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.342 . . . . 65.44 110.861 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.3 p90 -155.47 153.18 26.1 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.517 0.675 . . . . 74.23 110.898 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 154.83 67.11 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.659 2.24 . . . . 75.54 112.388 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.27 149.66 64.11 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.659 0.742 . . . . 74.52 111.159 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 49.77 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 72.14 112.341 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.18 151.92 0.24 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.7 0.762 . . . . 74.23 110.937 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.71 131.87 22.2 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.748 2.299 . . . . 74.35 112.319 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.44 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.5 Cg_endo -69.79 133.34 25.3 Favored 'Cis proline' 0 C--O 1.231 0.137 0 C-N-CA 122.695 -1.794 . . . . 75.14 112.307 -0.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -59.91 -18.87 48.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 75.23 110.843 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.41 123.78 43.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.441 . . . . 73.2 110.896 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.7 t0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.923 179.957 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.798 0.332 . . . . 72.24 110.881 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -148.16 152.97 40.73 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.604 0.716 . . . . 74.33 110.905 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 157.91 58.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 75.33 112.348 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.27 149.67 61.57 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.637 0.732 . . . . 71.43 111.125 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 50.02 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.662 2.241 . . . . 70.53 112.392 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 173.0 151.37 0.23 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.683 0.754 . . . . 75.03 110.922 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.4 Cg_endo -69.71 131.97 22.44 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.762 2.308 . . . . 74.24 112.328 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.449 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.66 133.4 25.31 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.677 -1.801 . . . . 73.03 112.38 -0.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.03 -18.88 49.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 71.31 110.885 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -117.86 123.52 46.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 75.12 110.882 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.872 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.891 0.377 . . . . 72.22 110.87 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 23.2 p90 -147.53 152.94 42.95 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.533 0.682 . . . . 74.54 110.938 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.87 158.33 57.19 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 54.14 112.305 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.17 149.78 62.29 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.621 0.724 . . . . 75.11 111.171 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 50.09 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.708 2.272 . . . . 63.13 112.325 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.87 151.38 0.23 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.63 0.729 . . . . 73.12 110.956 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.446 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.72 132.01 22.5 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.662 2.242 . . . . 75.05 112.341 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.42 25.48 Favored 'Cis proline' 0 C--O 1.231 0.167 0 C-N-CA 122.649 -1.813 . . . . 74.11 112.351 -0.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -59.89 -18.86 47.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 75.25 110.929 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -117.53 123.4 46.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.213 -0.448 . . . . 52.23 110.857 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.8 0.333 . . . . 64.32 110.924 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -147.85 153.08 42.03 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.601 0.715 . . . . 75.35 110.896 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.82 159.69 52.44 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.713 2.276 . . . . 55.54 112.304 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -139.81 149.7 60.16 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.633 0.73 . . . . 74.52 111.154 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 49.99 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.71 2.273 . . . . 61.24 112.345 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.94 151.24 0.23 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.795 0.807 . . . . 74.32 110.869 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.45 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.05 22.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.638 2.226 . . . . 64.04 112.336 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.45 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.8 133.42 25.65 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.619 -1.826 . . . . 72.3 112.353 -0.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -59.97 -19.11 50.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.42 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -116.15 122.59 45.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.108 -0.496 . . . . 74.24 110.889 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.889 179.92 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.809 0.338 . . . . 75.23 110.851 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.1 151.34 6.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.486 0.66 . . . . 70.22 110.902 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.51 41.78 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.639 2.226 . . . . 71.34 112.364 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -139.98 149.79 60.0 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.604 0.716 . . . . 72.12 111.13 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.77 50.21 0.79 Allowed 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.675 2.25 . . . . 74.23 112.303 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.75 150.57 0.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.667 0.746 . . . . 73.21 110.908 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.454 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.12 22.53 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.647 2.232 . . . . 70.34 112.307 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.454 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.0 Cg_endo -69.76 133.61 26.32 Favored 'Cis proline' 0 C--N 1.34 0.131 0 C-N-CA 122.715 -1.785 . . . . 73.3 112.314 -0.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -60.0 -18.68 47.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 73.13 110.877 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -113.5 123.7 50.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 72.14 110.919 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.1 t70 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.165 -0.47 . . . . 64.54 110.909 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.8 m . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.868 0.366 . . . . 63.02 110.854 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.1 151.37 6.58 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 72.23 110.961 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 162.54 41.68 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 74.44 112.325 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -140.01 149.75 59.75 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.607 0.718 . . . . 72.12 111.148 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 50.2 0.79 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.726 2.284 . . . . 72.33 112.32 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.72 150.51 0.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.73 0.776 . . . . 65.43 110.897 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.69 132.05 22.62 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.758 2.305 . . . . 73.53 112.33 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.73 133.69 26.54 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.654 -1.811 . . . . 74.51 112.336 -0.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.15 -18.56 48.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.291 -0.413 . . . . 73.44 110.862 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.45 123.81 50.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 73.2 110.874 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 70.41 110.823 179.994 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.828 0.347 . . . . 70.23 110.84 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.11 151.4 6.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.533 0.682 . . . . 61.41 110.922 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 162.63 41.35 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.636 2.224 . . . . 55.24 112.359 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -140.1 149.74 59.49 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.583 0.706 . . . . 62.25 111.163 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 50.18 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.28 . . . . 72.31 112.354 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.75 150.49 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.669 0.747 . . . . 72.34 110.908 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.8 Cg_endo -69.75 132.14 22.72 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.619 2.213 . . . . 61.41 112.352 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.457 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.2 Cg_endo -69.8 133.66 26.56 Favored 'Cis proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 -1.801 . . . . 74.21 112.332 -0.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -60.09 -18.5 47.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.859 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.53 123.72 50.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.119 -0.491 . . . . 73.22 110.876 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.2 t70 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.795 -179.937 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.758 0.313 . . . . 73.54 110.87 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.06 151.47 6.68 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-O 121.656 0.741 . . . . 74.15 110.855 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.83 40.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.739 2.293 . . . . 71.35 112.305 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -140.34 149.73 58.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.63 0.729 . . . . 75.54 111.112 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 50.15 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.715 2.277 . . . . 75.54 112.337 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.79 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.745 0.783 . . . . 75.11 110.882 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.84 132.09 22.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.695 2.263 . . . . 74.22 112.311 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.456 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.79 133.66 26.54 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.67 -1.804 . . . . 74.33 112.33 -0.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -60.04 -18.56 47.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 73.42 110.911 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -113.48 123.7 50.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 63.13 110.906 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 74.24 110.887 179.955 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.747 0.308 . . . . 75.01 110.946 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.17 151.39 6.53 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.612 0.72 . . . . 75.41 110.92 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 162.6 41.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.675 2.25 . . . . 73.35 112.328 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -140.03 149.78 59.79 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.605 0.717 . . . . 75.52 111.082 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 50.14 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.6 2.2 . . . . 61.5 112.412 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.84 150.54 0.22 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.597 0.713 . . . . 75.21 110.964 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.77 132.13 22.66 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.722 2.282 . . . . 74.11 112.343 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.5 Cg_endo -69.64 133.69 26.41 Favored 'Cis proline' 0 C--O 1.233 0.23 0 C-N-CA 122.666 -1.806 . . . . 72.05 112.408 -0.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -60.16 -18.56 48.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.274 -0.421 . . . . 75.1 110.898 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -113.5 123.75 50.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.923 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 75.2 110.833 -179.969 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.85 0.357 . . . . 74.42 110.876 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.19 151.35 6.49 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.556 0.693 . . . . 74.5 110.882 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 162.4 42.18 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 71.32 112.425 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -139.86 149.8 60.37 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.612 0.72 . . . . 74.2 111.212 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 50.17 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.734 2.29 . . . . 73.21 112.33 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.77 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.653 0.74 . . . . 74.2 110.948 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.79 132.08 22.53 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.661 2.241 . . . . 73.34 112.336 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.9 Cg_endo -69.83 133.62 26.47 Favored 'Cis proline' 0 C--N 1.342 0.232 0 C-N-CA 122.649 -1.813 . . . . 74.24 112.347 0.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -60.05 -18.53 47.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -113.53 123.76 50.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.53 110.857 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 72.23 110.852 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.832 0.349 . . . . 72.31 110.938 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.14 151.39 6.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 75.14 110.903 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 162.45 42.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.663 2.242 . . . . 74.34 112.394 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -139.86 149.78 60.26 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 75.33 111.143 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 50.27 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.654 2.236 . . . . 73.2 112.302 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.72 150.58 0.22 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.713 0.768 . . . . 72.22 110.919 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.9 Cg_endo -69.79 132.14 22.66 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.676 2.251 . . . . 72.41 112.309 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.3 Cg_endo -69.68 133.55 25.92 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.745 -1.773 . . . . 75.42 112.37 -0.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.01 -18.62 47.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 62.23 110.869 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.41 123.61 50.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.901 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 t0 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.883 179.913 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 m . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.806 0.336 . . . . 74.22 110.863 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -147.47 151.43 39.82 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.728 . . . . 72.24 110.892 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 166.96 25.87 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.65 2.234 . . . . 71.01 112.393 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -144.56 149.24 43.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.621 0.724 . . . . 72.32 111.121 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 50.28 0.78 Allowed 'Trans proline' 0 C--O 1.233 0.232 0 C-N-CA 122.698 2.265 . . . . 63.11 112.405 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.82 149.95 0.22 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.646 0.736 . . . . 75.53 110.957 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.85 132.25 22.79 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.65 2.234 . . . . 75.51 112.335 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.9 Cg_endo -69.69 133.78 26.84 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 -1.786 . . . . 75.25 112.359 -0.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.24 -18.18 46.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 64.22 110.855 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -111.98 122.97 49.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 72.35 110.92 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 63.42 110.851 179.995 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.806 0.336 . . . . 73.31 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.09 151.52 62.29 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.536 0.684 . . . . 74.2 110.901 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 165.24 31.63 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.662 2.241 . . . . 50.25 112.331 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 m -143.73 149.08 45.42 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.651 0.739 . . . . 75.03 111.142 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 50.41 0.81 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.661 2.241 . . . . 75.12 112.326 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.8 p90 172.82 149.89 0.22 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.709 0.766 . . . . 65.3 110.921 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.72 132.11 22.72 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 72.51 112.355 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.457 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.75 133.68 26.57 Favored 'Cis proline' 0 C--N 1.341 0.152 0 C-N-CA 122.659 -1.809 . . . . 71.21 112.377 -0.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -60.05 -18.45 46.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 73.23 110.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.67 123.15 49.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.864 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.877 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.823 0.344 . . . . 71.34 110.925 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.87 151.37 59.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.591 0.71 . . . . 72.54 110.859 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 165.1 32.03 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.727 2.285 . . . . 74.21 112.335 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.64 149.02 45.55 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.654 0.74 . . . . 73.34 111.118 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.71 50.37 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 70.34 112.336 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.83 149.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.661 0.743 . . . . 73.12 110.875 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.2 Cg_endo -69.72 132.08 22.63 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.693 2.262 . . . . 75.13 112.387 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.456 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.58 26.1 Favored 'Cis proline' 0 C--O 1.231 0.173 0 C-N-CA 122.725 -1.781 . . . . 75.04 112.349 -0.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -60.07 -18.33 46.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.272 -0.422 . . . . 64.31 110.874 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -112.86 123.2 49.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 75.43 110.908 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 t0 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 73.0 110.92 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.886 0.374 . . . . 64.4 110.834 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.13 151.29 6.51 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.529 0.68 . . . . 74.52 110.966 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.72 162.52 41.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.661 2.241 . . . . 74.55 112.378 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -140.0 149.77 59.85 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.629 0.728 . . . . 70.44 111.187 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 50.15 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.705 2.27 . . . . 73.31 112.38 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.8 150.54 0.22 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.626 0.727 . . . . 75.1 110.884 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.71 132.13 22.76 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.679 2.252 . . . . 70.1 112.394 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.456 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.76 133.62 26.36 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.693 -1.795 . . . . 72.02 112.359 -0.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -60.05 -18.54 47.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.902 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -113.58 123.81 50.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.51 110.891 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.9 t70 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.849 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.84 0.352 . . . . 70.41 110.856 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -170.94 150.92 3.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.526 0.679 . . . . 63.51 110.936 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 148.99 66.28 Favored 'Trans proline' 0 N--CA 1.465 -0.15 0 C-N-CA 122.729 2.286 . . . . 74.51 112.33 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.29 146.4 61.86 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.616 0.722 . . . . 73.31 111.121 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.87 50.66 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 75.12 112.295 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.4 p90 173.37 148.87 0.22 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 75.14 110.956 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.68 132.38 23.34 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.774 2.316 . . . . 73.43 112.318 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.448 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.74 133.79 26.96 Favored 'Cis proline' 0 C--N 1.341 0.153 0 C-N-CA 122.682 -1.799 . . . . 71.0 112.376 -0.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.29 -18.53 50.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 74.34 110.861 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -116.78 125.49 51.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.24 110.905 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 73.55 110.888 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.814 0.34 . . . . 73.14 110.882 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.1 p90 -170.71 150.88 3.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.548 0.689 . . . . 72.41 110.981 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 149.32 67.08 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.669 2.246 . . . . 74.22 112.363 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.67 146.41 61.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.681 0.753 . . . . 74.32 111.096 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 50.66 0.83 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.706 2.271 . . . . 72.01 112.355 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.2 p90 173.35 148.97 0.22 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.568 0.699 . . . . 75.23 110.971 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.447 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.2 Cg_endo -69.87 132.39 23.05 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.66 2.24 . . . . 75.24 112.303 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.447 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.2 Cg_endo -69.89 133.85 27.44 Favored 'Cis proline' 0 C--N 1.341 0.158 0 C-N-CA 122.674 -1.802 . . . . 75.34 112.26 0.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -60.34 -18.5 50.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 73.11 110.824 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -117.1 125.58 51.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.846 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 70.14 110.88 179.976 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.494 -0.242 . . . . 52.4 112.494 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m -137.13 123.97 21.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.865 0.364 . . . . 72.25 110.87 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.2 p90 -153.6 153.17 28.65 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.576 0.703 . . . . 74.15 110.945 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 154.24 67.97 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.702 2.268 . . . . 74.51 112.343 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.12 149.63 64.33 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.591 0.71 . . . . 75.2 111.097 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 50.06 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.719 2.279 . . . . 72.12 112.276 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.01 151.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.71 0.767 . . . . 73.21 110.854 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.466 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.4 Cg_endo -69.86 131.92 22.08 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.69 2.26 . . . . 74.41 112.281 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.466 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.1 Cg_endo -69.68 133.33 25.11 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.688 -1.797 . . . . 71.22 112.356 -0.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.86 -18.87 47.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 75.33 110.883 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -120.7 124.11 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.886 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -103.95 145.98 29.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 75.11 110.817 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.6 t -161.9 123.41 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.494 . . . . 75.43 110.909 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -123.14 72.62 46.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.551 0.691 . . . . 74.55 110.851 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 158.38 57.11 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.699 2.266 . . . . 73.31 112.361 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.7 t30 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.25 110.957 -179.995 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.416 -0.274 . . . . 72.53 112.416 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m -136.58 122.37 19.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 52.43 110.904 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -152.56 153.14 30.09 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.524 0.678 . . . . 73.21 110.994 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.82 153.71 68.33 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.66 2.24 . . . . 64.3 112.303 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.67 149.6 65.34 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 72.31 111.153 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 50.02 0.76 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.686 2.258 . . . . 73.45 112.352 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.96 151.94 0.23 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.697 0.761 . . . . 73.41 110.925 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.435 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.71 131.89 22.26 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.222 . . . . 61.23 112.392 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.435 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.7 Cg_endo -69.77 133.29 25.1 Favored 'Cis proline' 0 C--O 1.231 0.138 0 C-N-CA 122.656 -1.81 . . . . 74.11 112.322 -0.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -59.82 -18.81 46.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.901 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -120.83 124.0 43.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.905 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.6 145.35 30.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 73.3 110.83 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.9 t -161.94 123.43 2.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.921 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -158.79 72.97 3.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.544 0.687 . . . . 72.21 110.918 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.77 143.48 50.95 Favored 'Trans proline' 0 C--O 1.23 0.108 0 C-N-CA 122.698 2.265 . . . . 60.02 112.29 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 65.24 110.923 -179.989 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.436 -0.266 . . . . 71.01 112.436 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 m -136.2 125.66 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.738 0.304 . . . . 72.35 110.933 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -154.61 153.1 27.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.51 0.671 . . . . 75.42 110.917 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 153.73 68.45 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.65 2.233 . . . . 72.45 112.283 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -137.21 149.78 67.02 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.635 0.731 . . . . 71.14 111.103 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 50.01 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.654 2.236 . . . . 54.31 112.356 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.98 151.96 0.23 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.621 0.724 . . . . 62.5 110.976 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.444 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.0 Cg_endo -69.77 131.84 22.06 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.655 2.237 . . . . 74.41 112.317 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.444 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.7 Cg_endo -69.83 133.33 25.34 Favored 'Cis proline' 0 C--N 1.342 0.224 0 C-N-CA 122.667 -1.806 . . . . 72.45 112.307 -0.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -59.79 -18.9 47.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.891 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -120.54 123.41 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 75.54 110.912 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -103.43 146.92 27.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.133 -0.485 . . . . 64.1 110.927 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.6 t -161.98 123.5 2.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 65.0 110.854 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 tptp -122.33 72.66 38.12 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.558 0.694 . . . . 72.01 110.902 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 154.97 67.05 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.672 2.248 . . . . 64.11 112.368 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 73.35 110.832 -179.994 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.406 -0.278 . . . . 74.43 112.406 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.4 m -135.6 126.69 27.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.817 0.342 . . . . 65.44 110.861 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.3 p90 -155.47 153.18 26.1 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.517 0.675 . . . . 74.23 110.898 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 154.83 67.11 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.659 2.24 . . . . 75.54 112.388 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.27 149.66 64.11 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.659 0.742 . . . . 74.52 111.159 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 49.77 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 72.14 112.341 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.18 151.92 0.24 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.7 0.762 . . . . 74.23 110.937 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.44 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.71 131.87 22.2 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.748 2.299 . . . . 74.35 112.319 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.44 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.5 Cg_endo -69.79 133.34 25.3 Favored 'Cis proline' 0 C--O 1.231 0.137 0 C-N-CA 122.695 -1.794 . . . . 75.14 112.307 -0.06 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -59.91 -18.87 48.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 75.23 110.843 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.41 123.78 43.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.441 . . . . 73.2 110.896 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -104.3 146.24 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.923 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.5 t -161.85 123.38 2.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 73.01 110.867 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -117.73 72.96 8.39 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.608 0.718 . . . . 71.44 110.877 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 154.42 67.72 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.66 2.24 . . . . 71.14 112.348 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.1 t30 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 71.23 110.899 179.991 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 112.517 -0.233 . . . . 53.34 112.517 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.7 m -135.51 122.46 21.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 72.24 110.881 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -148.16 152.97 40.73 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.604 0.716 . . . . 74.33 110.905 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 157.91 58.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 75.33 112.348 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.27 149.67 61.57 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.637 0.732 . . . . 71.43 111.125 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 50.02 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.662 2.241 . . . . 70.53 112.392 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 173.0 151.37 0.23 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.683 0.754 . . . . 75.03 110.922 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.4 Cg_endo -69.71 131.97 22.44 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.762 2.308 . . . . 74.24 112.328 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.449 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.66 133.4 25.31 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.677 -1.801 . . . . 73.03 112.38 -0.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.03 -18.88 49.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 71.31 110.885 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -117.86 123.52 46.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 75.12 110.882 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -106.48 144.96 32.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.872 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 25.5 t -162.02 123.52 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.873 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -113.68 73.64 2.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.583 0.706 . . . . 73.54 110.972 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.8 155.22 66.35 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.636 2.224 . . . . 75.54 112.371 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 65.24 110.839 -179.941 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.474 -0.25 . . . . 75.21 112.474 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.9 m -135.51 122.33 21.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.891 0.377 . . . . 72.22 110.87 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 23.2 p90 -147.53 152.94 42.95 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.533 0.682 . . . . 74.54 110.938 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.87 158.33 57.19 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 54.14 112.305 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.17 149.78 62.29 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.621 0.724 . . . . 75.11 111.171 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 50.09 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.708 2.272 . . . . 63.13 112.325 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.87 151.38 0.23 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.63 0.729 . . . . 73.12 110.956 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.446 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.72 132.01 22.5 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.662 2.242 . . . . 75.05 112.341 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.42 25.48 Favored 'Cis proline' 0 C--O 1.231 0.167 0 C-N-CA 122.649 -1.813 . . . . 74.11 112.351 -0.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -59.89 -18.86 47.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 75.25 110.929 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -117.53 123.4 46.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.95 145.1 32.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.213 -0.448 . . . . 52.23 110.857 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 29.7 t -161.95 123.47 2.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.899 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -113.72 73.81 2.27 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.548 0.689 . . . . 74.43 110.915 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 148.14 64.02 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.66 2.24 . . . . 74.41 112.319 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 64.41 110.906 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 N-CA-C 112.474 -0.25 . . . . 73.32 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 m -132.74 122.48 24.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.333 . . . . 64.32 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -147.85 153.08 42.03 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.601 0.715 . . . . 75.35 110.896 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.82 159.69 52.44 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.713 2.276 . . . . 55.54 112.304 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -139.81 149.7 60.16 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.633 0.73 . . . . 74.52 111.154 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 49.99 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.71 2.273 . . . . 61.24 112.345 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.94 151.24 0.23 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.795 0.807 . . . . 74.32 110.869 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.45 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.05 22.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.638 2.226 . . . . 64.04 112.336 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.45 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.8 133.42 25.65 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.619 -1.826 . . . . 72.3 112.353 -0.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -59.97 -19.11 50.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 74.42 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -116.15 122.59 45.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.108 -0.496 . . . . 74.24 110.889 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -107.36 144.64 33.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.889 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 t -161.93 123.72 2.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 74.43 110.924 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -113.37 74.57 2.14 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.541 0.686 . . . . 73.2 110.874 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 157.77 59.12 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.63 2.22 . . . . 73.24 112.37 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.7 t30 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.927 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.386 0 N-CA-C 112.509 -0.236 . . . . 72.3 112.509 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -123.32 140.17 53.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.338 . . . . 75.23 110.851 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.1 151.34 6.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.486 0.66 . . . . 70.22 110.902 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.51 41.78 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.639 2.226 . . . . 71.34 112.364 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -139.98 149.79 60.0 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.604 0.716 . . . . 72.12 111.13 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.77 50.21 0.79 Allowed 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.675 2.25 . . . . 74.23 112.303 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.75 150.57 0.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.667 0.746 . . . . 73.21 110.908 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.454 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.12 22.53 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.647 2.232 . . . . 70.34 112.307 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.454 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.0 Cg_endo -69.76 133.61 26.32 Favored 'Cis proline' 0 C--N 1.34 0.131 0 C-N-CA 122.715 -1.785 . . . . 73.3 112.314 -0.007 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -60.0 -18.68 47.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 73.13 110.877 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -113.5 123.7 50.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 72.14 110.919 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -109.69 158.6 17.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.165 -0.47 . . . . 64.54 110.909 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 145.3 21.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 73.23 110.839 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -145.4 70.28 14.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.606 0.717 . . . . 63.14 110.909 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 141.49 45.45 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.668 2.245 . . . . 55.03 112.38 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.2 t30 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 74.32 110.933 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.489 -0.244 . . . . 75.43 112.489 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.8 m -124.0 140.15 53.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 63.02 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.1 151.37 6.58 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 72.23 110.961 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 162.54 41.68 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 74.44 112.325 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -140.01 149.75 59.75 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.607 0.718 . . . . 72.12 111.148 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 50.2 0.79 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.726 2.284 . . . . 72.33 112.32 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.72 150.51 0.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.73 0.776 . . . . 65.43 110.897 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.46 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.69 132.05 22.62 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.758 2.305 . . . . 73.53 112.33 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.73 133.69 26.54 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.654 -1.811 . . . . 74.51 112.336 -0.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.15 -18.56 48.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.291 -0.413 . . . . 73.44 110.862 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.45 123.81 50.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 73.2 110.874 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.87 158.62 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 70.41 110.823 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 142.82 19.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 62.52 110.88 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.0 tttp -140.55 71.95 31.0 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 72.32 110.931 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 132.74 24.0 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.696 2.264 . . . . 75.31 112.341 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.878 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.428 -0.269 . . . . 71.04 112.428 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -124.04 140.21 53.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.828 0.347 . . . . 70.23 110.84 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.11 151.4 6.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.533 0.682 . . . . 61.41 110.922 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 162.63 41.35 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.636 2.224 . . . . 55.24 112.359 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -140.1 149.74 59.49 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.583 0.706 . . . . 62.25 111.163 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 50.18 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.28 . . . . 72.31 112.354 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.75 150.49 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.669 0.747 . . . . 72.34 110.908 -179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.8 Cg_endo -69.75 132.14 22.72 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.619 2.213 . . . . 61.41 112.352 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.457 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.2 Cg_endo -69.8 133.66 26.56 Favored 'Cis proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 -1.801 . . . . 74.21 112.332 -0.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -60.09 -18.5 47.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 74.41 110.859 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.53 123.72 50.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.119 -0.491 . . . . 73.22 110.876 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -109.86 158.62 17.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.795 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.31 143.86 20.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.863 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -146.43 71.88 12.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.599 0.714 . . . . 73.1 110.838 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 153.2 69.29 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.665 2.243 . . . . 75.32 112.324 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 75.23 110.932 179.982 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.398 -0.281 . . . . 73.14 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.9 m -126.11 140.24 52.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.758 0.313 . . . . 73.54 110.87 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.06 151.47 6.68 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-O 121.656 0.741 . . . . 74.15 110.855 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.83 40.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.739 2.293 . . . . 71.35 112.305 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -140.34 149.73 58.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.63 0.729 . . . . 75.54 111.112 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 50.15 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.715 2.277 . . . . 75.54 112.337 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.79 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.745 0.783 . . . . 75.11 110.882 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.84 132.09 22.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.695 2.263 . . . . 74.22 112.311 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.456 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.79 133.66 26.54 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.67 -1.804 . . . . 74.33 112.33 -0.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -60.04 -18.56 47.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 73.42 110.911 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -113.48 123.7 50.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 63.13 110.906 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.83 158.81 17.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 74.24 110.887 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.3 146.8 23.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 72.04 110.862 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -150.98 71.08 8.66 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.599 0.714 . . . . 75.21 110.927 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 133.77 26.36 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.681 2.254 . . . . 73.45 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 74.53 110.911 -179.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.509 -0.236 . . . . 75.15 112.509 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m -123.54 140.14 53.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.747 0.308 . . . . 75.01 110.946 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.17 151.39 6.53 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.612 0.72 . . . . 75.41 110.92 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 162.6 41.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.675 2.25 . . . . 73.35 112.328 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -140.03 149.78 59.79 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.605 0.717 . . . . 75.52 111.082 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 50.14 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.6 2.2 . . . . 61.5 112.412 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.84 150.54 0.22 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.597 0.713 . . . . 75.21 110.964 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.77 132.13 22.66 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.722 2.282 . . . . 74.11 112.343 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.5 Cg_endo -69.64 133.69 26.41 Favored 'Cis proline' 0 C--O 1.233 0.23 0 C-N-CA 122.666 -1.806 . . . . 72.05 112.408 -0.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -60.16 -18.56 48.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.274 -0.421 . . . . 75.1 110.898 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -113.5 123.75 50.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.923 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -109.82 158.63 17.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 75.2 110.833 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 143.85 20.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 72.15 110.922 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -157.19 69.87 4.43 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.576 0.703 . . . . 62.15 110.865 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 155.06 66.71 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.623 2.215 . . . . 74.24 112.411 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 73.23 110.868 -179.893 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.485 -0.246 . . . . 74.23 112.485 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m -124.71 140.22 53.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 74.42 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.19 151.35 6.49 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.556 0.693 . . . . 74.5 110.882 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 162.4 42.18 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 71.32 112.425 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -139.86 149.8 60.37 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.612 0.72 . . . . 74.2 111.212 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 50.17 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.734 2.29 . . . . 73.21 112.33 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.77 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.653 0.74 . . . . 74.2 110.948 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.79 132.08 22.53 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.661 2.241 . . . . 73.34 112.336 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.9 Cg_endo -69.83 133.62 26.47 Favored 'Cis proline' 0 C--N 1.342 0.232 0 C-N-CA 122.649 -1.813 . . . . 74.24 112.347 0.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -60.05 -18.53 47.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -113.53 123.76 50.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 72.53 110.857 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -109.82 158.54 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 72.23 110.852 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.35 145.18 21.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 74.13 110.869 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -146.26 72.0 13.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.485 0.66 . . . . 74.3 110.851 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 136.76 33.84 Favored 'Trans proline' 0 N--CA 1.466 -0.131 0 C-N-CA 122.714 2.276 . . . . 73.34 112.355 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 72.24 110.919 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.459 -0.256 . . . . 65.34 112.459 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m -123.56 140.18 53.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.832 0.349 . . . . 72.31 110.938 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.14 151.39 6.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 75.14 110.903 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 162.45 42.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.663 2.242 . . . . 74.34 112.394 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -139.86 149.78 60.26 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 75.33 111.143 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 50.27 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.654 2.236 . . . . 73.2 112.302 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.72 150.58 0.22 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.713 0.768 . . . . 72.22 110.919 -179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.9 Cg_endo -69.79 132.14 22.66 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.676 2.251 . . . . 72.41 112.309 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.3 Cg_endo -69.68 133.55 25.92 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.745 -1.773 . . . . 75.42 112.37 -0.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.01 -18.62 47.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 62.23 110.869 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.41 123.61 50.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.901 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -109.67 158.62 17.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.883 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.42 144.84 21.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.11 110.814 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -159.3 69.71 3.32 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.49 0.662 . . . . 75.34 110.88 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 151.94 69.41 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.715 2.277 . . . . 75.25 112.346 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 71.53 110.815 -179.973 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 N-CA-C 112.434 -0.266 . . . . 73.5 112.434 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 m -134.28 129.53 35.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 74.22 110.863 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -147.47 151.43 39.82 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.728 . . . . 72.24 110.892 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 166.96 25.87 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.65 2.234 . . . . 71.01 112.393 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -144.56 149.24 43.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.621 0.724 . . . . 72.32 111.121 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 50.28 0.78 Allowed 'Trans proline' 0 C--O 1.233 0.232 0 C-N-CA 122.698 2.265 . . . . 63.11 112.405 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.82 149.95 0.22 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.646 0.736 . . . . 75.53 110.957 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.458 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.85 132.25 22.79 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.65 2.234 . . . . 75.51 112.335 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.9 Cg_endo -69.69 133.78 26.84 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 -1.786 . . . . 75.25 112.359 -0.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.24 -18.18 46.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 64.22 110.855 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -111.98 122.97 49.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 72.35 110.92 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -113.41 94.25 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 63.42 110.851 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -108.85 123.26 48.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 64.02 110.888 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -161.33 74.15 2.53 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.608 0.718 . . . . 75.45 110.901 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 148.24 64.99 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.64 2.227 . . . . 73.42 112.382 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 75.43 110.894 -179.989 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 N-CA-C 112.446 -0.262 . . . . 74.11 112.446 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.0 m -129.49 123.79 32.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 73.31 110.899 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.09 151.52 62.29 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.536 0.684 . . . . 74.2 110.901 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 165.24 31.63 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.662 2.241 . . . . 50.25 112.331 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 m -143.73 149.08 45.42 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.651 0.739 . . . . 75.03 111.142 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 50.41 0.81 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.661 2.241 . . . . 75.12 112.326 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.8 p90 172.82 149.89 0.22 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.709 0.766 . . . . 65.3 110.921 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.72 132.11 22.72 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 72.51 112.355 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.457 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.75 133.68 26.57 Favored 'Cis proline' 0 C--N 1.341 0.152 0 C-N-CA 122.659 -1.809 . . . . 71.21 112.377 -0.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -60.05 -18.45 46.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 73.23 110.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.67 123.15 49.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.864 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -111.5 96.06 5.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 75.21 110.877 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.1 t -109.73 123.4 49.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.867 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -113.37 74.71 2.16 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.552 0.691 . . . . 72.44 110.884 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 152.86 69.55 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.666 2.244 . . . . 71.21 112.335 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.7 p30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 61.54 110.895 -179.961 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.256 0 N-CA-C 112.46 -0.256 . . . . 64.42 112.46 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 m -135.91 124.03 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.823 0.344 . . . . 71.34 110.925 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.87 151.37 59.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.591 0.71 . . . . 72.54 110.859 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 165.1 32.03 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.727 2.285 . . . . 74.21 112.335 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.64 149.02 45.55 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.654 0.74 . . . . 73.34 111.118 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.71 50.37 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 70.34 112.336 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.83 149.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.661 0.743 . . . . 73.12 110.875 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.2 Cg_endo -69.72 132.08 22.63 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.693 2.262 . . . . 75.13 112.387 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.456 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.58 26.1 Favored 'Cis proline' 0 C--O 1.231 0.173 0 C-N-CA 122.725 -1.781 . . . . 75.04 112.349 -0.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -60.07 -18.33 46.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.272 -0.422 . . . . 64.31 110.874 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -112.86 123.2 49.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 75.43 110.908 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -111.54 95.63 5.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 73.0 110.92 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.3 t -109.44 123.42 49.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 75.23 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.4 ttpp -113.37 74.76 2.17 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.713 . . . . 65.33 110.894 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 152.25 69.0 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.67 2.247 . . . . 64.45 112.34 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 72.25 110.843 -179.931 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 N-CA-C 112.496 -0.242 . . . . 63.24 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m -125.0 140.24 53.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 64.4 110.834 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.13 151.29 6.51 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.529 0.68 . . . . 74.52 110.966 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.72 162.52 41.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.661 2.241 . . . . 74.55 112.378 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -140.0 149.77 59.85 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.629 0.728 . . . . 70.44 111.187 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 50.15 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.705 2.27 . . . . 73.31 112.38 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.4 p90 172.8 150.54 0.22 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.626 0.727 . . . . 75.1 110.884 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.71 132.13 22.76 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.679 2.252 . . . . 70.1 112.394 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.456 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.76 133.62 26.36 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.693 -1.795 . . . . 72.02 112.359 -0.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -60.05 -18.54 47.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.902 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -113.58 123.81 50.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 74.51 110.891 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -109.83 158.6 18.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.849 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.28 142.52 19.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 71.41 110.887 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -143.33 70.09 17.83 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.537 0.684 . . . . 74.54 110.891 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.68 149.51 67.5 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.771 2.314 . . . . 71.01 112.365 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 72.11 110.867 -179.998 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.399 0 N-CA-C 112.485 -0.246 . . . . 74.33 112.485 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.2 t -126.78 148.15 49.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.84 0.352 . . . . 70.41 110.856 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -170.94 150.92 3.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.526 0.679 . . . . 63.51 110.936 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 148.99 66.28 Favored 'Trans proline' 0 N--CA 1.465 -0.15 0 C-N-CA 122.729 2.286 . . . . 74.51 112.33 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.29 146.4 61.86 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.616 0.722 . . . . 73.31 111.121 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.87 50.66 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 75.12 112.295 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.4 p90 173.37 148.87 0.22 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 75.14 110.956 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.448 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.68 132.38 23.34 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.774 2.316 . . . . 73.43 112.318 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.448 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.74 133.79 26.96 Favored 'Cis proline' 0 C--N 1.341 0.153 0 C-N-CA 122.682 -1.799 . . . . 71.0 112.376 -0.118 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.29 -18.53 50.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 74.34 110.861 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -116.78 125.49 51.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.24 110.905 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -119.81 113.83 21.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 73.55 110.888 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.8 m -120.81 123.7 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 73.21 110.923 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -133.3 72.31 75.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.591 0.71 . . . . 74.14 110.909 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.7 153.62 68.97 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.676 2.251 . . . . 72.35 112.372 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.32 110.871 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.522 -0.231 . . . . 65.03 112.522 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.98 147.93 50.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.814 0.34 . . . . 73.14 110.882 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.1 p90 -170.71 150.88 3.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.548 0.689 . . . . 72.41 110.981 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 149.32 67.08 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.669 2.246 . . . . 74.22 112.363 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.67 146.41 61.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.681 0.753 . . . . 74.32 111.096 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 50.66 0.83 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.706 2.271 . . . . 72.01 112.355 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.2 p90 173.35 148.97 0.22 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.568 0.699 . . . . 75.23 110.971 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.447 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.2 Cg_endo -69.87 132.39 23.05 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.66 2.24 . . . . 75.24 112.303 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.447 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.2 Cg_endo -69.89 133.85 27.44 Favored 'Cis proline' 0 C--N 1.341 0.158 0 C-N-CA 122.674 -1.802 . . . . 75.34 112.26 0.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -60.34 -18.5 50.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 73.11 110.824 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -117.1 125.58 51.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.846 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -119.86 113.88 21.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 70.14 110.88 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.4 m -120.73 123.73 43.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.3 110.963 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -123.7 72.63 52.04 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 70.33 110.845 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 145.63 57.83 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.702 2.268 . . . . 75.4 112.359 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.3 p30 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 75.34 110.935 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.865 0.364 . . . . 64.15 110.87 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.2 p90 -153.6 153.17 28.65 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.576 0.703 . . . . 74.15 110.945 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 154.24 67.97 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.702 2.268 . . . . 74.51 112.343 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.12 149.63 64.33 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.591 0.71 . . . . 75.2 111.097 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 50.06 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.719 2.279 . . . . 52.3 112.276 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.01 151.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.71 0.767 . . . . 73.21 110.854 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.4 Cg_endo -69.86 131.92 22.08 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.69 2.26 . . . . 60.32 112.281 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.1 Cg_endo -69.68 133.33 25.11 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.688 -1.797 . . . . 71.2 112.356 -0.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.86 -18.87 47.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 75.33 110.883 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -120.7 124.11 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.886 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t0 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 63.42 110.817 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.782 0.325 . . . . 52.43 110.904 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -152.56 153.14 30.09 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.524 0.678 . . . . 73.21 110.994 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.82 153.71 68.33 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.66 2.24 . . . . 64.3 112.303 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.67 149.6 65.34 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 72.11 111.153 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 50.02 0.76 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.686 2.258 . . . . 73.45 112.352 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.96 151.94 0.23 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.697 0.761 . . . . 73.41 110.925 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.71 131.89 22.26 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.222 . . . . 61.23 112.392 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.7 Cg_endo -69.77 133.29 25.1 Favored 'Cis proline' 0 C--O 1.231 0.138 0 C-N-CA 122.656 -1.81 . . . . 74.11 112.322 -0.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -59.82 -18.81 46.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.901 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -120.83 124.0 43.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.905 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 t0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 73.3 110.83 179.981 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.738 0.304 . . . . 72.35 110.933 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -154.61 153.1 27.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.51 0.671 . . . . 75.42 110.917 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 153.73 68.45 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.65 2.233 . . . . 72.45 112.283 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -137.21 149.78 67.02 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.635 0.731 . . . . 71.14 111.103 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 50.01 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.654 2.236 . . . . 54.31 112.356 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.98 151.96 0.23 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.621 0.724 . . . . 62.43 110.976 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.0 Cg_endo -69.77 131.84 22.06 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.655 2.237 . . . . 74.41 112.317 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.7 Cg_endo -69.83 133.33 25.34 Favored 'Cis proline' 0 C--N 1.342 0.224 0 C-N-CA 122.667 -1.806 . . . . 72.45 112.307 -0.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -59.79 -18.9 47.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.891 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -120.54 123.41 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 75.54 110.912 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.133 -0.485 . . . . 64.1 110.927 179.939 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.4 m . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.342 . . . . 65.44 110.861 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.3 p90 -155.47 153.18 26.1 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.517 0.675 . . . . 72.42 110.898 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 154.83 67.11 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.659 2.24 . . . . 75.54 112.388 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.27 149.66 64.11 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.659 0.742 . . . . 64.4 111.159 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 49.77 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 72.14 112.341 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.18 151.92 0.24 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.7 0.762 . . . . 64.44 110.937 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.71 131.87 22.2 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.748 2.299 . . . . 74.35 112.319 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.515 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.5 Cg_endo -69.79 133.34 25.3 Favored 'Cis proline' 0 C--O 1.231 0.137 0 C-N-CA 122.695 -1.794 . . . . 75.14 112.307 -0.06 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -59.91 -18.87 48.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 72.52 110.843 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.41 123.78 43.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.441 . . . . 73.2 110.896 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.7 t0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.923 179.957 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.798 0.332 . . . . 72.24 110.881 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -148.16 152.97 40.73 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.604 0.716 . . . . 74.33 110.905 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 157.91 58.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 75.33 112.348 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.27 149.67 61.57 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.637 0.732 . . . . 71.43 111.125 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 50.02 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.662 2.241 . . . . 53.53 112.392 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 173.0 151.37 0.23 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.683 0.754 . . . . 72.33 110.922 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.4 Cg_endo -69.71 131.97 22.44 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.762 2.308 . . . . 74.24 112.328 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.528 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.66 133.4 25.31 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.677 -1.801 . . . . 71.41 112.38 -0.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.03 -18.88 49.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 71.31 110.885 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -117.86 123.52 46.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 75.12 110.882 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.872 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.891 0.377 . . . . 72.22 110.87 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 23.2 p90 -147.53 152.94 42.95 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.533 0.682 . . . . 74.54 110.938 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.87 158.33 57.19 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 54.14 112.305 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.17 149.78 62.29 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.621 0.724 . . . . 75.11 111.171 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 50.09 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.708 2.272 . . . . 63.13 112.325 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.87 151.38 0.23 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.63 0.729 . . . . 73.12 110.956 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.526 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.72 132.01 22.5 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.662 2.242 . . . . 52.41 112.341 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.42 25.48 Favored 'Cis proline' 0 C--O 1.231 0.167 0 C-N-CA 122.649 -1.813 . . . . 74.11 112.351 -0.092 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -59.89 -18.86 47.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.929 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -117.53 123.4 46.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.213 -0.448 . . . . 52.23 110.857 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.8 0.333 . . . . 64.32 110.924 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -147.85 153.08 42.03 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.601 0.715 . . . . 75.35 110.896 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.82 159.69 52.44 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.713 2.276 . . . . 55.54 112.304 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -139.81 149.7 60.16 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.633 0.73 . . . . 74.23 111.154 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 49.99 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.71 2.273 . . . . 60.44 112.345 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.94 151.24 0.23 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.795 0.807 . . . . 74.32 110.869 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.531 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.05 22.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.638 2.226 . . . . 64.04 112.336 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.8 133.42 25.65 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.619 -1.826 . . . . 72.3 112.353 -0.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -59.97 -19.11 50.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 64.32 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -116.15 122.59 45.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.108 -0.496 . . . . 74.24 110.889 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.889 179.92 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.809 0.338 . . . . 75.23 110.851 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.1 151.34 6.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.486 0.66 . . . . 70.22 110.902 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.51 41.78 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.639 2.226 . . . . 71.12 112.364 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -139.98 149.79 60.0 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.604 0.716 . . . . 64.22 111.13 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.77 50.21 0.79 Allowed 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.675 2.25 . . . . 74.23 112.303 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.57 0.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.667 0.746 . . . . 70.41 110.908 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.12 22.53 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.647 2.232 . . . . 70.34 112.307 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.0 Cg_endo -69.76 133.61 26.32 Favored 'Cis proline' 0 C--N 1.34 0.131 0 C-N-CA 122.715 -1.785 . . . . 73.3 112.314 -0.007 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -60.0 -18.68 47.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 73.13 110.877 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -113.5 123.7 50.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 72.14 110.919 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.1 t70 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.165 -0.47 . . . . 64.54 110.909 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.8 m . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.868 0.366 . . . . 63.02 110.854 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.1 151.37 6.58 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 61.32 110.961 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 162.54 41.68 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 70.13 112.325 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.01 149.75 59.75 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.607 0.718 . . . . 70.51 111.148 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 50.2 0.79 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.726 2.284 . . . . 72.33 112.32 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.51 0.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.73 0.776 . . . . 64.53 110.897 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.542 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.69 132.05 22.62 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.758 2.305 . . . . 63.3 112.33 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.73 133.69 26.54 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.654 -1.811 . . . . 74.51 112.336 -0.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.15 -18.56 48.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.291 -0.413 . . . . 73.44 110.862 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.45 123.81 50.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 73.2 110.874 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 63.52 110.823 179.994 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.828 0.347 . . . . 70.23 110.84 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.11 151.4 6.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.533 0.682 . . . . 61.41 110.922 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 162.63 41.35 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.636 2.224 . . . . 55.24 112.359 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.1 149.74 59.49 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.583 0.706 . . . . 44.5 111.163 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 50.18 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.28 . . . . 72.31 112.354 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.41 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.49 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.669 0.747 . . . . 71.5 110.908 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.8 Cg_endo -69.75 132.14 22.72 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.619 2.213 . . . . 44.44 112.352 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.2 Cg_endo -69.8 133.66 26.56 Favored 'Cis proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 -1.801 . . . . 74.21 112.332 -0.075 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -60.09 -18.5 47.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 54.15 110.859 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.53 123.72 50.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.119 -0.491 . . . . 54.35 110.876 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.2 t70 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.795 -179.937 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.758 0.313 . . . . 73.54 110.87 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.06 151.47 6.68 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-O 121.656 0.741 . . . . 74.15 110.855 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.83 40.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.739 2.293 . . . . 71.35 112.305 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.34 149.73 58.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.63 0.729 . . . . 75.54 111.112 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 50.15 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.715 2.277 . . . . 75.54 112.337 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.79 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.745 0.783 . . . . 74.1 110.882 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.84 132.09 22.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.695 2.263 . . . . 61.33 112.311 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.79 133.66 26.54 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.67 -1.804 . . . . 74.33 112.33 -0.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -60.04 -18.56 47.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 73.42 110.911 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -113.48 123.7 50.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 54.44 110.906 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 74.24 110.887 179.955 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.747 0.308 . . . . 74.21 110.946 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.17 151.39 6.53 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.612 0.72 . . . . 75.41 110.92 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 162.6 41.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.675 2.25 . . . . 73.35 112.328 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.03 149.78 59.79 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.605 0.717 . . . . 75.52 111.082 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 50.14 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.6 2.2 . . . . 61.5 112.412 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.84 150.54 0.22 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.597 0.713 . . . . 73.22 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.77 132.13 22.66 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.722 2.282 . . . . 74.11 112.343 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.5 Cg_endo -69.64 133.69 26.41 Favored 'Cis proline' 0 C--O 1.233 0.23 0 C-N-CA 122.666 -1.806 . . . . 72.05 112.408 -0.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -60.16 -18.56 48.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.274 -0.421 . . . . 73.33 110.898 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -113.5 123.75 50.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.923 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 75.2 110.833 -179.969 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.85 0.357 . . . . 64.53 110.876 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.19 151.35 6.49 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.556 0.693 . . . . 73.44 110.882 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 162.4 42.18 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 71.32 112.425 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.8 60.37 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.612 0.72 . . . . 74.2 111.212 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 50.17 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.734 2.29 . . . . 71.43 112.33 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.77 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.653 0.74 . . . . 74.2 110.948 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.79 132.08 22.53 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.661 2.241 . . . . 73.34 112.336 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.9 Cg_endo -69.83 133.62 26.47 Favored 'Cis proline' 0 C--N 1.342 0.232 0 C-N-CA 122.649 -1.813 . . . . 74.24 112.347 0.008 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -60.05 -18.53 47.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -113.53 123.76 50.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 44.33 110.857 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 63.45 110.852 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.832 0.349 . . . . 63.42 110.938 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.14 151.39 6.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 75.14 110.903 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 162.45 42.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.663 2.242 . . . . 74.34 112.394 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.78 60.26 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 75.33 111.143 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 50.27 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.654 2.236 . . . . 52.43 112.302 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.58 0.22 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.713 0.768 . . . . 72.22 110.919 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.544 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.9 Cg_endo -69.79 132.14 22.66 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.676 2.251 . . . . 70.13 112.309 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.544 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.3 Cg_endo -69.68 133.55 25.92 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.745 -1.773 . . . . 74.14 112.37 -0.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.01 -18.62 47.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 62.05 110.869 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.41 123.61 50.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.901 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 t0 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.883 179.913 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 m . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.806 0.336 . . . . 74.22 110.863 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -147.47 151.43 39.82 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.728 . . . . 60.24 110.892 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 166.96 25.87 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.65 2.234 . . . . 63.33 112.393 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -144.56 149.24 43.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.621 0.724 . . . . 65.22 111.121 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 50.28 0.78 Allowed 'Trans proline' 0 C--O 1.233 0.232 0 C-N-CA 122.698 2.265 . . . . 63.11 112.405 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.82 149.95 0.22 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.646 0.736 . . . . 75.53 110.957 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.525 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.85 132.25 22.79 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.65 2.234 . . . . 75.51 112.335 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.525 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.9 Cg_endo -69.69 133.78 26.84 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 -1.786 . . . . 64.21 112.359 -0.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.24 -18.18 46.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 64.22 110.855 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -111.98 122.97 49.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 61.52 110.92 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 62.14 110.851 179.995 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.806 0.336 . . . . 73.31 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.09 151.52 62.29 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.536 0.684 . . . . 74.2 110.901 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 165.24 31.63 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.662 2.241 . . . . 35.43 112.331 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 m -143.73 149.08 45.42 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.651 0.739 . . . . 61.42 111.142 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 50.41 0.81 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.661 2.241 . . . . 75.12 112.326 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.8 p90 172.82 149.89 0.22 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.709 0.766 . . . . 65.3 110.921 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.522 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.72 132.11 22.72 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 72.51 112.355 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.75 133.68 26.57 Favored 'Cis proline' 0 C--N 1.341 0.152 0 C-N-CA 122.659 -1.809 . . . . 61.43 112.377 -0.12 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -60.05 -18.45 46.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.67 123.15 49.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.864 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.877 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.823 0.344 . . . . 61.4 110.925 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.87 151.37 59.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.591 0.71 . . . . 72.54 110.859 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 165.1 32.03 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.727 2.285 . . . . 71.0 112.335 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.64 149.02 45.55 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.654 0.74 . . . . 64.23 111.118 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.71 50.37 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 70.34 112.336 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.83 149.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.661 0.743 . . . . 73.12 110.875 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.2 Cg_endo -69.72 132.08 22.63 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.693 2.262 . . . . 70.53 112.387 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.58 26.1 Favored 'Cis proline' 0 C--O 1.231 0.173 0 C-N-CA 122.725 -1.781 . . . . 75.04 112.349 -0.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -60.07 -18.33 46.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.272 -0.422 . . . . 52.1 110.874 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -112.86 123.2 49.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 75.1 110.908 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 t0 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 73.0 110.92 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.886 0.374 . . . . 64.4 110.834 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.13 151.29 6.51 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.529 0.68 . . . . 74.52 110.966 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.72 162.52 41.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.661 2.241 . . . . 62.22 112.378 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.0 149.77 59.85 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.629 0.728 . . . . 70.44 111.187 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 50.15 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.705 2.27 . . . . 73.31 112.38 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.8 150.54 0.22 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.626 0.727 . . . . 75.1 110.884 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.71 132.13 22.76 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.679 2.252 . . . . 70.1 112.394 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.76 133.62 26.36 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.693 -1.795 . . . . 72.02 112.359 -0.077 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -60.05 -18.54 47.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.902 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -113.58 123.81 50.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.891 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.9 t70 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.849 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.84 0.352 . . . . 54.33 110.856 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -170.94 150.92 3.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.526 0.679 . . . . 52.13 110.936 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 148.99 66.28 Favored 'Trans proline' 0 N--CA 1.465 -0.15 0 C-N-CA 122.729 2.286 . . . . 74.51 112.33 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.29 146.4 61.86 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.616 0.722 . . . . 72.14 111.121 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.87 50.66 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 75.12 112.295 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.4 p90 173.37 148.87 0.22 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 74.31 110.956 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.68 132.38 23.34 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.774 2.316 . . . . 73.43 112.318 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.74 133.79 26.96 Favored 'Cis proline' 0 C--N 1.341 0.153 0 C-N-CA 122.682 -1.799 . . . . 35.14 112.376 -0.118 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.29 -18.53 50.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 60.3 110.861 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -116.78 125.49 51.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.24 110.905 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 73.55 110.888 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.814 0.34 . . . . 73.14 110.882 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.1 p90 -170.71 150.88 3.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.548 0.689 . . . . 72.41 110.981 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 149.32 67.08 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.669 2.246 . . . . 74.22 112.363 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.67 146.41 61.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.681 0.753 . . . . 74.32 111.096 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 50.66 0.83 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.706 2.271 . . . . 72.01 112.355 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.2 p90 173.35 148.97 0.22 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.568 0.699 . . . . 75.23 110.971 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.2 Cg_endo -69.87 132.39 23.05 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.66 2.24 . . . . 75.24 112.303 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.2 Cg_endo -69.89 133.85 27.44 Favored 'Cis proline' 0 C--N 1.341 0.158 0 C-N-CA 122.674 -1.802 . . . . 75.34 112.26 0.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -60.34 -18.5 50.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 72.34 110.824 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -117.1 125.58 51.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.846 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 70.14 110.88 179.976 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.494 -0.242 . . . . 45.03 112.494 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m -137.13 123.97 21.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.865 0.364 . . . . 64.15 110.87 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.2 p90 -153.6 153.17 28.65 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.576 0.703 . . . . 74.15 110.945 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 154.24 67.97 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.702 2.268 . . . . 74.51 112.343 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.12 149.63 64.33 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.591 0.71 . . . . 75.2 111.097 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 50.06 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.719 2.279 . . . . 52.3 112.276 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.01 151.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.71 0.767 . . . . 73.21 110.854 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.4 Cg_endo -69.86 131.92 22.08 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.69 2.26 . . . . 60.32 112.281 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.1 Cg_endo -69.68 133.33 25.11 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.688 -1.797 . . . . 71.2 112.356 -0.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.86 -18.87 47.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 75.33 110.883 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -120.7 124.11 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.886 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -103.95 145.98 29.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 63.42 110.817 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.6 t -161.9 123.41 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.494 . . . . 75.43 110.909 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -123.14 72.62 46.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.551 0.691 . . . . 74.44 110.851 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 158.38 57.11 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.699 2.266 . . . . 73.31 112.361 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.7 t30 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.25 110.957 -179.995 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.416 -0.274 . . . . 72.53 112.416 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m -136.58 122.37 19.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 52.43 110.904 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -152.56 153.14 30.09 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.524 0.678 . . . . 73.21 110.994 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.82 153.71 68.33 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.66 2.24 . . . . 64.3 112.303 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.67 149.6 65.34 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 72.11 111.153 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 50.02 0.76 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.686 2.258 . . . . 73.45 112.352 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.96 151.94 0.23 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.697 0.761 . . . . 73.41 110.925 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.71 131.89 22.26 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.222 . . . . 61.23 112.392 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.7 Cg_endo -69.77 133.29 25.1 Favored 'Cis proline' 0 C--O 1.231 0.138 0 C-N-CA 122.656 -1.81 . . . . 74.11 112.322 -0.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -59.82 -18.81 46.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.901 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -120.83 124.0 43.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.905 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.6 145.35 30.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 73.3 110.83 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.9 t -161.94 123.43 2.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.921 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -158.79 72.97 3.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.544 0.687 . . . . 71.22 110.918 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.77 143.48 50.95 Favored 'Trans proline' 0 C--O 1.23 0.108 0 C-N-CA 122.698 2.265 . . . . 54.41 112.29 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 65.24 110.923 -179.989 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.436 -0.266 . . . . 71.01 112.436 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 m -136.2 125.66 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.738 0.304 . . . . 72.35 110.933 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -154.61 153.1 27.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.51 0.671 . . . . 75.42 110.917 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 153.73 68.45 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.65 2.233 . . . . 72.45 112.283 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -137.21 149.78 67.02 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.635 0.731 . . . . 71.14 111.103 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 50.01 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.654 2.236 . . . . 54.31 112.356 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.98 151.96 0.23 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.621 0.724 . . . . 62.43 110.976 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.0 Cg_endo -69.77 131.84 22.06 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.655 2.237 . . . . 74.41 112.317 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.7 Cg_endo -69.83 133.33 25.34 Favored 'Cis proline' 0 C--N 1.342 0.224 0 C-N-CA 122.667 -1.806 . . . . 72.45 112.307 -0.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -59.79 -18.9 47.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.891 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -120.54 123.41 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 75.54 110.912 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -103.43 146.92 27.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.133 -0.485 . . . . 64.1 110.927 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.6 t -161.98 123.5 2.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 64.32 110.854 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 tptp -122.33 72.66 38.12 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.558 0.694 . . . . 72.01 110.902 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 154.97 67.05 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.672 2.248 . . . . 62.22 112.368 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 73.35 110.832 -179.994 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.406 -0.278 . . . . 52.52 112.406 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.4 m -135.6 126.69 27.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.817 0.342 . . . . 65.44 110.861 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.3 p90 -155.47 153.18 26.1 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.517 0.675 . . . . 72.42 110.898 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 154.83 67.11 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.659 2.24 . . . . 75.54 112.388 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.27 149.66 64.11 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.659 0.742 . . . . 64.4 111.159 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 49.77 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 72.14 112.341 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.18 151.92 0.24 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.7 0.762 . . . . 64.44 110.937 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.71 131.87 22.2 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.748 2.299 . . . . 74.35 112.319 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.515 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.5 Cg_endo -69.79 133.34 25.3 Favored 'Cis proline' 0 C--O 1.231 0.137 0 C-N-CA 122.695 -1.794 . . . . 75.14 112.307 -0.06 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -59.91 -18.87 48.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 72.52 110.843 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.41 123.78 43.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.441 . . . . 73.2 110.896 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -104.3 146.24 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.923 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.5 t -161.85 123.38 2.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 73.01 110.867 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -117.73 72.96 8.39 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.608 0.718 . . . . 71.44 110.877 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 154.42 67.72 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.66 2.24 . . . . 64.35 112.348 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.1 t30 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 50.41 110.899 179.991 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 112.517 -0.233 . . . . 53.34 112.517 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.7 m -135.51 122.46 21.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 72.24 110.881 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -148.16 152.97 40.73 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.604 0.716 . . . . 74.33 110.905 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 157.91 58.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 75.33 112.348 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.27 149.67 61.57 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.637 0.732 . . . . 71.43 111.125 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 50.02 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.662 2.241 . . . . 53.53 112.392 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 173.0 151.37 0.23 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.683 0.754 . . . . 72.33 110.922 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.4 Cg_endo -69.71 131.97 22.44 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.762 2.308 . . . . 74.24 112.328 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.528 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.66 133.4 25.31 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.677 -1.801 . . . . 71.41 112.38 -0.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.03 -18.88 49.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 71.31 110.885 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -117.86 123.52 46.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 75.12 110.882 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -106.48 144.96 32.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.872 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 25.5 t -162.02 123.52 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.873 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -113.68 73.64 2.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.583 0.706 . . . . 55.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.8 155.22 66.35 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.636 2.224 . . . . 75.54 112.371 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 65.24 110.839 -179.941 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.474 -0.25 . . . . 75.21 112.474 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.9 m -135.51 122.33 21.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.891 0.377 . . . . 72.22 110.87 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 23.2 p90 -147.53 152.94 42.95 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.533 0.682 . . . . 74.54 110.938 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.87 158.33 57.19 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 54.14 112.305 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.17 149.78 62.29 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.621 0.724 . . . . 75.11 111.171 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 50.09 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.708 2.272 . . . . 63.13 112.325 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.87 151.38 0.23 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.63 0.729 . . . . 73.12 110.956 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.526 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.72 132.01 22.5 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.662 2.242 . . . . 52.41 112.341 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.42 25.48 Favored 'Cis proline' 0 C--O 1.231 0.167 0 C-N-CA 122.649 -1.813 . . . . 74.11 112.351 -0.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -59.89 -18.86 47.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.929 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -117.53 123.4 46.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.95 145.1 32.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.213 -0.448 . . . . 52.23 110.857 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 29.7 t -161.95 123.47 2.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.899 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -113.72 73.81 2.27 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.548 0.689 . . . . 63.03 110.915 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 148.14 64.02 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.66 2.24 . . . . 70.41 112.319 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 64.41 110.906 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 N-CA-C 112.474 -0.25 . . . . 65.02 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 m -132.74 122.48 24.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.333 . . . . 64.32 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -147.85 153.08 42.03 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.601 0.715 . . . . 75.35 110.896 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.82 159.69 52.44 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.713 2.276 . . . . 55.54 112.304 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -139.81 149.7 60.16 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.633 0.73 . . . . 74.23 111.154 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 49.99 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.71 2.273 . . . . 60.44 112.345 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.94 151.24 0.23 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.795 0.807 . . . . 74.32 110.869 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.531 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.05 22.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.638 2.226 . . . . 64.04 112.336 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.8 133.42 25.65 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.619 -1.826 . . . . 72.3 112.353 -0.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -59.97 -19.11 50.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 64.32 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -116.15 122.59 45.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.108 -0.496 . . . . 74.24 110.889 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -107.36 144.64 33.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.889 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 t -161.93 123.72 2.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 74.43 110.924 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -113.37 74.57 2.14 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.541 0.686 . . . . 55.23 110.874 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 157.77 59.12 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.63 2.22 . . . . 73.24 112.37 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.7 t30 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.228 -0.442 . . . . 61.11 110.927 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.386 0 N-CA-C 112.509 -0.236 . . . . 72.3 112.509 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -123.32 140.17 53.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.338 . . . . 75.23 110.851 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.1 151.34 6.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.486 0.66 . . . . 70.22 110.902 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.51 41.78 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.639 2.226 . . . . 71.12 112.364 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -139.98 149.79 60.0 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.604 0.716 . . . . 64.22 111.13 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.77 50.21 0.79 Allowed 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.675 2.25 . . . . 74.23 112.303 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.57 0.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.667 0.746 . . . . 70.41 110.908 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.12 22.53 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.647 2.232 . . . . 70.34 112.307 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.0 Cg_endo -69.76 133.61 26.32 Favored 'Cis proline' 0 C--N 1.34 0.131 0 C-N-CA 122.715 -1.785 . . . . 73.3 112.314 -0.007 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -60.0 -18.68 47.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 73.13 110.877 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -113.5 123.7 50.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 72.14 110.919 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -109.69 158.6 17.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.165 -0.47 . . . . 64.54 110.909 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 145.3 21.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 73.23 110.839 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -145.4 70.28 14.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.606 0.717 . . . . 63.14 110.909 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 141.49 45.45 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.668 2.245 . . . . 55.03 112.38 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.2 t30 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 74.32 110.933 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.489 -0.244 . . . . 75.43 112.489 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.8 m -124.0 140.15 53.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 63.02 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.1 151.37 6.58 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 61.32 110.961 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 162.54 41.68 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 70.13 112.325 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.01 149.75 59.75 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.607 0.718 . . . . 70.51 111.148 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 50.2 0.79 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.726 2.284 . . . . 72.33 112.32 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.51 0.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.73 0.776 . . . . 64.53 110.897 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.542 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.69 132.05 22.62 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.758 2.305 . . . . 63.3 112.33 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.73 133.69 26.54 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.654 -1.811 . . . . 74.51 112.336 -0.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.15 -18.56 48.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.291 -0.413 . . . . 73.44 110.862 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.45 123.81 50.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 73.2 110.874 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.87 158.62 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 63.52 110.823 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 142.82 19.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 62.52 110.88 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.0 tttp -140.55 71.95 31.0 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 72.04 110.931 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 132.74 24.0 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.696 2.264 . . . . 75.31 112.341 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.878 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.428 -0.269 . . . . 40.33 112.428 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -124.04 140.21 53.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.828 0.347 . . . . 70.23 110.84 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.11 151.4 6.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.533 0.682 . . . . 61.41 110.922 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 162.63 41.35 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.636 2.224 . . . . 55.24 112.359 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.1 149.74 59.49 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.583 0.706 . . . . 44.5 111.163 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 50.18 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.28 . . . . 72.31 112.354 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.41 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.49 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.669 0.747 . . . . 71.5 110.908 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.8 Cg_endo -69.75 132.14 22.72 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.619 2.213 . . . . 44.44 112.352 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.2 Cg_endo -69.8 133.66 26.56 Favored 'Cis proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 -1.801 . . . . 74.21 112.332 -0.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -60.09 -18.5 47.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 54.15 110.859 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.53 123.72 50.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.119 -0.491 . . . . 54.35 110.876 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -109.86 158.62 17.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.795 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.31 143.86 20.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.863 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -146.43 71.88 12.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.599 0.714 . . . . 65.21 110.838 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 153.2 69.29 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.665 2.243 . . . . 71.05 112.324 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 75.23 110.932 179.982 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.398 -0.281 . . . . 73.14 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.9 m -126.11 140.24 52.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.758 0.313 . . . . 73.54 110.87 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.06 151.47 6.68 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-O 121.656 0.741 . . . . 74.15 110.855 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.83 40.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.739 2.293 . . . . 71.35 112.305 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.34 149.73 58.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.63 0.729 . . . . 75.54 111.112 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 50.15 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.715 2.277 . . . . 75.54 112.337 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.79 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.745 0.783 . . . . 74.1 110.882 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.84 132.09 22.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.695 2.263 . . . . 61.33 112.311 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.79 133.66 26.54 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.67 -1.804 . . . . 74.33 112.33 -0.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -60.04 -18.56 47.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 73.42 110.911 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -113.48 123.7 50.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 54.44 110.906 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.83 158.81 17.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 74.24 110.887 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.3 146.8 23.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 72.04 110.862 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -150.98 71.08 8.66 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.599 0.714 . . . . 75.21 110.927 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 133.77 26.36 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.681 2.254 . . . . 73.45 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 74.53 110.911 -179.994 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.509 -0.236 . . . . 75.15 112.509 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m -123.54 140.14 53.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.747 0.308 . . . . 74.21 110.946 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.17 151.39 6.53 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.612 0.72 . . . . 75.41 110.92 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 162.6 41.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.675 2.25 . . . . 73.35 112.328 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.03 149.78 59.79 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.605 0.717 . . . . 75.52 111.082 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 50.14 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.6 2.2 . . . . 61.5 112.412 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.84 150.54 0.22 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.597 0.713 . . . . 73.22 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.77 132.13 22.66 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.722 2.282 . . . . 74.11 112.343 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.5 Cg_endo -69.64 133.69 26.41 Favored 'Cis proline' 0 C--O 1.233 0.23 0 C-N-CA 122.666 -1.806 . . . . 72.05 112.408 -0.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -60.16 -18.56 48.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.274 -0.421 . . . . 73.33 110.898 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -113.5 123.75 50.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.923 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -109.82 158.63 17.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 75.2 110.833 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 143.85 20.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.13 110.922 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -157.19 69.87 4.43 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.576 0.703 . . . . 62.15 110.865 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 155.06 66.71 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.623 2.215 . . . . 74.24 112.411 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 73.23 110.868 -179.893 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.485 -0.246 . . . . 74.23 112.485 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m -124.71 140.22 53.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 64.53 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.19 151.35 6.49 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.556 0.693 . . . . 73.44 110.882 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 162.4 42.18 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 71.32 112.425 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.8 60.37 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.612 0.72 . . . . 74.2 111.212 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 50.17 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.734 2.29 . . . . 71.43 112.33 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.77 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.653 0.74 . . . . 74.2 110.948 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.79 132.08 22.53 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.661 2.241 . . . . 73.34 112.336 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.9 Cg_endo -69.83 133.62 26.47 Favored 'Cis proline' 0 C--N 1.342 0.232 0 C-N-CA 122.649 -1.813 . . . . 74.24 112.347 0.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -60.05 -18.53 47.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -113.53 123.76 50.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 44.33 110.857 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -109.82 158.54 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 63.45 110.852 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.35 145.18 21.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 74.13 110.869 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -146.26 72.0 13.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.485 0.66 . . . . 74.3 110.851 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 136.76 33.84 Favored 'Trans proline' 0 N--CA 1.466 -0.131 0 C-N-CA 122.714 2.276 . . . . 73.34 112.355 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 72.24 110.919 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.459 -0.256 . . . . 65.34 112.459 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m -123.56 140.18 53.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.832 0.349 . . . . 63.42 110.938 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.14 151.39 6.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 75.14 110.903 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 162.45 42.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.663 2.242 . . . . 74.34 112.394 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.78 60.26 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 75.33 111.143 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 50.27 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.654 2.236 . . . . 52.43 112.302 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.58 0.22 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.713 0.768 . . . . 72.22 110.919 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.544 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.9 Cg_endo -69.79 132.14 22.66 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.676 2.251 . . . . 70.13 112.309 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.544 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.3 Cg_endo -69.68 133.55 25.92 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.745 -1.773 . . . . 74.14 112.37 -0.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.01 -18.62 47.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 62.05 110.869 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.41 123.61 50.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.901 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -109.67 158.62 17.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.883 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.42 144.84 21.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.11 110.814 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -159.3 69.71 3.32 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.49 0.662 . . . . 75.34 110.88 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 151.94 69.41 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.715 2.277 . . . . 75.25 112.346 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 71.53 110.815 -179.973 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 N-CA-C 112.434 -0.266 . . . . 72.53 112.434 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 m -134.28 129.53 35.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 74.22 110.863 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -147.47 151.43 39.82 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.728 . . . . 60.24 110.892 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 166.96 25.87 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.65 2.234 . . . . 63.33 112.393 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -144.56 149.24 43.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.621 0.724 . . . . 65.22 111.121 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 50.28 0.78 Allowed 'Trans proline' 0 C--O 1.233 0.232 0 C-N-CA 122.698 2.265 . . . . 63.11 112.405 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.82 149.95 0.22 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.646 0.736 . . . . 75.53 110.957 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.525 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.85 132.25 22.79 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.65 2.234 . . . . 75.51 112.335 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.525 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.9 Cg_endo -69.69 133.78 26.84 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 -1.786 . . . . 64.21 112.359 -0.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.24 -18.18 46.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 64.22 110.855 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -111.98 122.97 49.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 61.52 110.92 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -113.41 94.25 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 62.14 110.851 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -108.85 123.26 48.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 64.02 110.888 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -161.33 74.15 2.53 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.608 0.718 . . . . 64.54 110.901 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 148.24 64.99 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.64 2.227 . . . . 73.42 112.382 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 75.43 110.894 -179.989 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 N-CA-C 112.446 -0.262 . . . . 73.0 112.446 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.0 m -129.49 123.79 32.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 73.31 110.899 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.09 151.52 62.29 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.536 0.684 . . . . 74.2 110.901 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 165.24 31.63 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.662 2.241 . . . . 35.43 112.331 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 m -143.73 149.08 45.42 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.651 0.739 . . . . 61.42 111.142 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 50.41 0.81 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.661 2.241 . . . . 75.12 112.326 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.8 p90 172.82 149.89 0.22 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.709 0.766 . . . . 65.3 110.921 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.522 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.72 132.11 22.72 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 72.51 112.355 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.75 133.68 26.57 Favored 'Cis proline' 0 C--N 1.341 0.152 0 C-N-CA 122.659 -1.809 . . . . 61.43 112.377 -0.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -60.05 -18.45 46.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.67 123.15 49.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.864 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -111.5 96.06 5.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.877 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.1 t -109.73 123.4 49.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.867 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -113.37 74.71 2.16 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.552 0.691 . . . . 72.12 110.884 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 152.86 69.55 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.666 2.244 . . . . 50.24 112.335 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.7 p30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 61.54 110.895 -179.961 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.256 0 N-CA-C 112.46 -0.256 . . . . 52.15 112.46 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 m -135.91 124.03 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.823 0.344 . . . . 61.4 110.925 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.87 151.37 59.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.591 0.71 . . . . 72.54 110.859 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 165.1 32.03 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.727 2.285 . . . . 71.0 112.335 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.64 149.02 45.55 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.654 0.74 . . . . 64.23 111.118 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.71 50.37 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 70.34 112.336 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.83 149.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.661 0.743 . . . . 73.12 110.875 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.2 Cg_endo -69.72 132.08 22.63 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.693 2.262 . . . . 70.53 112.387 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.58 26.1 Favored 'Cis proline' 0 C--O 1.231 0.173 0 C-N-CA 122.725 -1.781 . . . . 75.04 112.349 -0.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -60.07 -18.33 46.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.272 -0.422 . . . . 52.1 110.874 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -112.86 123.2 49.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 75.1 110.908 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -111.54 95.63 5.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 73.0 110.92 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.3 t -109.44 123.42 49.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 75.23 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.4 ttpp -113.37 74.76 2.17 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.713 . . . . 62.25 110.894 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 152.25 69.0 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.67 2.247 . . . . 64.45 112.34 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 72.25 110.843 -179.931 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 N-CA-C 112.496 -0.242 . . . . 34.34 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m -125.0 140.24 53.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 64.4 110.834 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.13 151.29 6.51 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.529 0.68 . . . . 74.52 110.966 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.72 162.52 41.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.661 2.241 . . . . 62.22 112.378 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.0 149.77 59.85 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.629 0.728 . . . . 70.44 111.187 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 50.15 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.705 2.27 . . . . 73.31 112.38 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.8 150.54 0.22 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.626 0.727 . . . . 75.1 110.884 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.71 132.13 22.76 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.679 2.252 . . . . 70.1 112.394 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.76 133.62 26.36 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.693 -1.795 . . . . 72.02 112.359 -0.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -60.05 -18.54 47.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.902 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -113.58 123.81 50.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.891 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -109.83 158.6 18.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.849 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.28 142.52 19.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 71.41 110.887 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -143.33 70.09 17.83 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.537 0.684 . . . . 74.54 110.891 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.68 149.51 67.5 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.771 2.314 . . . . 71.01 112.365 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 70.41 110.867 -179.998 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.399 0 N-CA-C 112.485 -0.246 . . . . 64.34 112.485 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.2 t -126.78 148.15 49.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.84 0.352 . . . . 54.33 110.856 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -170.94 150.92 3.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.526 0.679 . . . . 52.13 110.936 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 148.99 66.28 Favored 'Trans proline' 0 N--CA 1.465 -0.15 0 C-N-CA 122.729 2.286 . . . . 74.51 112.33 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.29 146.4 61.86 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.616 0.722 . . . . 72.14 111.121 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.87 50.66 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 75.12 112.295 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.4 p90 173.37 148.87 0.22 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 74.31 110.956 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.68 132.38 23.34 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.774 2.316 . . . . 73.43 112.318 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.74 133.79 26.96 Favored 'Cis proline' 0 C--N 1.341 0.153 0 C-N-CA 122.682 -1.799 . . . . 35.14 112.376 -0.118 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.29 -18.53 50.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 60.3 110.861 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -116.78 125.49 51.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.24 110.905 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -119.81 113.83 21.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 73.55 110.888 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.8 m -120.81 123.7 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 73.21 110.923 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -133.3 72.31 75.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.591 0.71 . . . . 73.51 110.909 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.7 153.62 68.97 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.676 2.251 . . . . 72.35 112.372 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.32 110.871 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.522 -0.231 . . . . 65.03 112.522 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.98 147.93 50.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.814 0.34 . . . . 73.14 110.882 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.1 p90 -170.71 150.88 3.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.548 0.689 . . . . 72.41 110.981 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 149.32 67.08 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.669 2.246 . . . . 74.22 112.363 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.67 146.41 61.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.681 0.753 . . . . 74.32 111.096 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 50.66 0.83 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.706 2.271 . . . . 72.01 112.355 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.2 p90 173.35 148.97 0.22 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.568 0.699 . . . . 75.23 110.971 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.2 Cg_endo -69.87 132.39 23.05 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.66 2.24 . . . . 75.24 112.303 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.2 Cg_endo -69.89 133.85 27.44 Favored 'Cis proline' 0 C--N 1.341 0.158 0 C-N-CA 122.674 -1.802 . . . . 75.34 112.26 0.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -60.34 -18.5 50.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 72.34 110.824 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -117.1 125.58 51.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.846 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -119.86 113.88 21.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 70.14 110.88 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.4 m -120.73 123.73 43.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.3 110.963 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -123.7 72.63 52.04 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 65.33 110.845 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 145.63 57.83 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.702 2.268 . . . . 75.4 112.359 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.3 p30 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 75.34 110.935 179.957 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.865 0.364 . . . . 64.15 110.87 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.2 p90 -153.6 153.17 28.65 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.576 0.703 . . . . 74.15 110.945 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 154.24 67.97 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.702 2.268 . . . . 74.51 112.343 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.12 149.63 64.33 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.591 0.71 . . . . 75.2 111.097 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 50.06 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.719 2.279 . . . . 52.3 112.276 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.01 151.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.71 0.767 . . . . 73.21 110.854 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.4 Cg_endo -69.86 131.92 22.08 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.69 2.26 . . . . 60.32 112.281 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.1 Cg_endo -69.68 133.33 25.11 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.688 -1.797 . . . . 71.2 112.356 -0.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.86 -18.87 47.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 75.33 110.883 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -120.7 124.11 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.886 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t0 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 63.42 110.817 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.782 0.325 . . . . 52.43 110.904 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -152.56 153.14 30.09 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.524 0.678 . . . . 73.21 110.994 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.82 153.71 68.33 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.66 2.24 . . . . 64.3 112.303 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.67 149.6 65.34 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 72.11 111.153 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 50.02 0.76 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.686 2.258 . . . . 73.45 112.352 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.96 151.94 0.23 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.697 0.761 . . . . 73.41 110.925 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.71 131.89 22.26 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.222 . . . . 61.23 112.392 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.7 Cg_endo -69.77 133.29 25.1 Favored 'Cis proline' 0 C--O 1.231 0.138 0 C-N-CA 122.656 -1.81 . . . . 74.11 112.322 -0.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -59.82 -18.81 46.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.901 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -120.83 124.0 43.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.905 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 t0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 73.3 110.83 179.981 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.457 -0.094 0 CA-C-O 120.738 0.304 . . . . 72.35 110.933 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -154.61 153.1 27.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.51 0.671 . . . . 75.42 110.917 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 153.73 68.45 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.65 2.233 . . . . 72.45 112.283 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -137.21 149.78 67.02 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.635 0.731 . . . . 71.14 111.103 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 50.01 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.654 2.236 . . . . 54.31 112.356 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.98 151.96 0.23 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.621 0.724 . . . . 62.43 110.976 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.0 Cg_endo -69.77 131.84 22.06 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.655 2.237 . . . . 74.41 112.317 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.7 Cg_endo -69.83 133.33 25.34 Favored 'Cis proline' 0 C--N 1.342 0.224 0 C-N-CA 122.667 -1.806 . . . . 72.45 112.307 -0.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -59.79 -18.9 47.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.891 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -120.54 123.41 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 75.54 110.912 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.133 -0.485 . . . . 64.1 110.927 179.939 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.4 m . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.817 0.342 . . . . 65.44 110.861 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.3 p90 -155.47 153.18 26.1 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.517 0.675 . . . . 72.42 110.898 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 154.83 67.11 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.659 2.24 . . . . 75.54 112.388 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.27 149.66 64.11 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.659 0.742 . . . . 64.4 111.159 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 49.77 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 72.14 112.341 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.18 151.92 0.24 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.7 0.762 . . . . 64.44 110.937 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.71 131.87 22.2 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.748 2.299 . . . . 74.35 112.319 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.515 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.5 Cg_endo -69.79 133.34 25.3 Favored 'Cis proline' 0 C--O 1.231 0.137 0 C-N-CA 122.695 -1.794 . . . . 75.14 112.307 -0.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -59.91 -18.87 48.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 72.52 110.843 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.41 123.78 43.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.441 . . . . 73.2 110.896 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.7 t0 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.923 179.957 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.798 0.332 . . . . 72.24 110.881 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -148.16 152.97 40.73 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.604 0.716 . . . . 74.33 110.905 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 157.91 58.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 75.33 112.348 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.27 149.67 61.57 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.637 0.732 . . . . 71.43 111.125 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 50.02 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.662 2.241 . . . . 53.53 112.392 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 173.0 151.37 0.23 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.683 0.754 . . . . 72.33 110.922 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.4 Cg_endo -69.71 131.97 22.44 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.762 2.308 . . . . 74.24 112.328 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.528 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.66 133.4 25.31 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.677 -1.801 . . . . 71.41 112.38 -0.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.03 -18.88 49.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 71.31 110.885 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -117.86 123.52 46.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 75.12 110.882 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.872 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.891 0.377 . . . . 72.22 110.87 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 23.2 p90 -147.53 152.94 42.95 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.533 0.682 . . . . 74.54 110.938 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.87 158.33 57.19 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 54.14 112.305 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.17 149.78 62.29 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.621 0.724 . . . . 75.11 111.171 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 50.09 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.708 2.272 . . . . 63.13 112.325 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.87 151.38 0.23 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.63 0.729 . . . . 73.12 110.956 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.526 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.72 132.01 22.5 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.662 2.242 . . . . 52.41 112.341 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.42 25.48 Favored 'Cis proline' 0 C--O 1.231 0.167 0 C-N-CA 122.649 -1.813 . . . . 74.11 112.351 -0.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -59.89 -18.86 47.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.929 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -117.53 123.4 46.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.213 -0.448 . . . . 52.23 110.857 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 m . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.8 0.333 . . . . 64.32 110.924 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -147.85 153.08 42.03 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.601 0.715 . . . . 75.35 110.896 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.82 159.69 52.44 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.713 2.276 . . . . 55.54 112.304 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -139.81 149.7 60.16 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.633 0.73 . . . . 74.23 111.154 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 49.99 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.71 2.273 . . . . 60.44 112.345 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.94 151.24 0.23 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.795 0.807 . . . . 74.32 110.869 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.531 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.05 22.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.638 2.226 . . . . 64.04 112.336 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.8 133.42 25.65 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.619 -1.826 . . . . 72.3 112.353 -0.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -59.97 -19.11 50.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 64.32 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -116.15 122.59 45.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.108 -0.496 . . . . 74.24 110.889 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.889 179.92 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.809 0.338 . . . . 75.23 110.851 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.1 151.34 6.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.486 0.66 . . . . 70.22 110.902 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.51 41.78 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.639 2.226 . . . . 71.12 112.364 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -139.98 149.79 60.0 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.604 0.716 . . . . 64.22 111.13 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.77 50.21 0.79 Allowed 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.675 2.25 . . . . 74.23 112.303 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.57 0.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.667 0.746 . . . . 70.41 110.908 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.12 22.53 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.647 2.232 . . . . 70.34 112.307 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.0 Cg_endo -69.76 133.61 26.32 Favored 'Cis proline' 0 C--N 1.34 0.131 0 C-N-CA 122.715 -1.785 . . . . 73.3 112.314 -0.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -60.0 -18.68 47.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 73.13 110.877 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -113.5 123.7 50.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 72.14 110.919 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.1 t70 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.165 -0.47 . . . . 64.54 110.909 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.8 m . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.868 0.366 . . . . 63.02 110.854 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.1 151.37 6.58 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 61.32 110.961 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 162.54 41.68 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 70.13 112.325 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.01 149.75 59.75 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.607 0.718 . . . . 70.51 111.148 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 50.2 0.79 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.726 2.284 . . . . 72.33 112.32 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.51 0.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.73 0.776 . . . . 64.53 110.897 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.542 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.69 132.05 22.62 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.758 2.305 . . . . 63.3 112.33 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.73 133.69 26.54 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.654 -1.811 . . . . 74.51 112.336 -0.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.15 -18.56 48.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.291 -0.413 . . . . 73.44 110.862 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.45 123.81 50.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 73.2 110.874 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 63.52 110.823 179.994 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.828 0.347 . . . . 70.23 110.84 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.11 151.4 6.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.533 0.682 . . . . 61.41 110.922 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 162.63 41.35 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.636 2.224 . . . . 55.24 112.359 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.1 149.74 59.49 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.583 0.706 . . . . 44.5 111.163 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 50.18 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.28 . . . . 72.31 112.354 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.41 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.49 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.669 0.747 . . . . 71.5 110.908 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.8 Cg_endo -69.75 132.14 22.72 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.619 2.213 . . . . 44.44 112.352 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.2 Cg_endo -69.8 133.66 26.56 Favored 'Cis proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 -1.801 . . . . 74.21 112.332 -0.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -60.09 -18.5 47.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 54.15 110.859 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.53 123.72 50.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.119 -0.491 . . . . 54.35 110.876 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.2 t70 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.795 -179.937 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.9 m . . . . . 0 N--CA 1.457 -0.077 0 CA-C-O 120.758 0.313 . . . . 73.54 110.87 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.06 151.47 6.68 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-O 121.656 0.741 . . . . 74.15 110.855 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.83 40.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.739 2.293 . . . . 71.35 112.305 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.34 149.73 58.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.63 0.729 . . . . 75.54 111.112 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 50.15 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.715 2.277 . . . . 75.54 112.337 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.79 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.745 0.783 . . . . 74.1 110.882 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.84 132.09 22.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.695 2.263 . . . . 61.33 112.311 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.79 133.66 26.54 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.67 -1.804 . . . . 74.33 112.33 -0.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -60.04 -18.56 47.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 73.42 110.911 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -113.48 123.7 50.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 54.44 110.906 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 74.24 110.887 179.955 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.747 0.308 . . . . 74.21 110.946 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.17 151.39 6.53 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.612 0.72 . . . . 75.41 110.92 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 162.6 41.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.675 2.25 . . . . 73.35 112.328 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.03 149.78 59.79 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.605 0.717 . . . . 75.52 111.082 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 50.14 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.6 2.2 . . . . 61.5 112.412 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.84 150.54 0.22 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.597 0.713 . . . . 73.22 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.77 132.13 22.66 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.722 2.282 . . . . 74.11 112.343 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.5 Cg_endo -69.64 133.69 26.41 Favored 'Cis proline' 0 C--O 1.233 0.23 0 C-N-CA 122.666 -1.806 . . . . 72.05 112.408 -0.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -60.16 -18.56 48.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.274 -0.421 . . . . 73.33 110.898 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -113.5 123.75 50.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.923 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 75.2 110.833 -179.969 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.85 0.357 . . . . 64.53 110.876 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.19 151.35 6.49 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.556 0.693 . . . . 73.44 110.882 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 162.4 42.18 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 71.32 112.425 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.8 60.37 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.612 0.72 . . . . 74.2 111.212 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 50.17 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.734 2.29 . . . . 71.43 112.33 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.77 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.653 0.74 . . . . 74.2 110.948 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.79 132.08 22.53 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.661 2.241 . . . . 73.34 112.336 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.9 Cg_endo -69.83 133.62 26.47 Favored 'Cis proline' 0 C--N 1.342 0.232 0 C-N-CA 122.649 -1.813 . . . . 74.24 112.347 0.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -60.05 -18.53 47.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -113.53 123.76 50.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 44.33 110.857 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 63.45 110.852 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.832 0.349 . . . . 63.42 110.938 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.14 151.39 6.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 75.14 110.903 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 162.45 42.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.663 2.242 . . . . 74.34 112.394 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.78 60.26 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 75.33 111.143 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 50.27 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.654 2.236 . . . . 52.43 112.302 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.58 0.22 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.713 0.768 . . . . 72.22 110.919 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.544 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.9 Cg_endo -69.79 132.14 22.66 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.676 2.251 . . . . 70.13 112.309 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.544 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.3 Cg_endo -69.68 133.55 25.92 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.745 -1.773 . . . . 74.14 112.37 -0.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.01 -18.62 47.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 62.05 110.869 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.41 123.61 50.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.901 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 t0 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.883 179.913 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 m . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.806 0.336 . . . . 74.22 110.863 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -147.47 151.43 39.82 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.728 . . . . 60.24 110.892 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 166.96 25.87 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.65 2.234 . . . . 63.33 112.393 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -144.56 149.24 43.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.621 0.724 . . . . 65.22 111.121 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 50.28 0.78 Allowed 'Trans proline' 0 C--O 1.233 0.232 0 C-N-CA 122.698 2.265 . . . . 63.11 112.405 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.82 149.95 0.22 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.646 0.736 . . . . 75.53 110.957 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.525 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.85 132.25 22.79 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.65 2.234 . . . . 75.51 112.335 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.525 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.9 Cg_endo -69.69 133.78 26.84 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 -1.786 . . . . 64.21 112.359 -0.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.24 -18.18 46.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 64.22 110.855 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -111.98 122.97 49.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 61.52 110.92 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 62.14 110.851 179.995 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.233 0.196 0 CA-C-O 120.806 0.336 . . . . 73.31 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.09 151.52 62.29 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.536 0.684 . . . . 74.2 110.901 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 165.24 31.63 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.662 2.241 . . . . 35.43 112.331 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 m -143.73 149.08 45.42 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.651 0.739 . . . . 61.42 111.142 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 50.41 0.81 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.661 2.241 . . . . 75.12 112.326 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.8 p90 172.82 149.89 0.22 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.709 0.766 . . . . 65.3 110.921 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.522 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.72 132.11 22.72 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 72.51 112.355 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.75 133.68 26.57 Favored 'Cis proline' 0 C--N 1.341 0.152 0 C-N-CA 122.659 -1.809 . . . . 61.43 112.377 -0.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -60.05 -18.45 46.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.67 123.15 49.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.864 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 t70 . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.877 179.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.457 -0.102 0 CA-C-O 120.823 0.344 . . . . 61.4 110.925 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.87 151.37 59.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.591 0.71 . . . . 72.54 110.859 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 165.1 32.03 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.727 2.285 . . . . 71.0 112.335 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.64 149.02 45.55 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.654 0.74 . . . . 64.23 111.118 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.71 50.37 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 70.34 112.336 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.83 149.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.661 0.743 . . . . 73.12 110.875 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.2 Cg_endo -69.72 132.08 22.63 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.693 2.262 . . . . 70.53 112.387 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.58 26.1 Favored 'Cis proline' 0 C--O 1.231 0.173 0 C-N-CA 122.725 -1.781 . . . . 75.04 112.349 -0.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -60.07 -18.33 46.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.272 -0.422 . . . . 52.1 110.874 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -112.86 123.2 49.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 75.1 110.908 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 t0 . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 73.0 110.92 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.886 0.374 . . . . 64.4 110.834 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.13 151.29 6.51 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.529 0.68 . . . . 74.52 110.966 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.72 162.52 41.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.661 2.241 . . . . 62.22 112.378 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.0 149.77 59.85 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.629 0.728 . . . . 70.44 111.187 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 50.15 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.705 2.27 . . . . 73.31 112.38 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.8 150.54 0.22 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.626 0.727 . . . . 75.1 110.884 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.71 132.13 22.76 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.679 2.252 . . . . 70.1 112.394 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.76 133.62 26.36 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.693 -1.795 . . . . 72.02 112.359 -0.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -60.05 -18.54 47.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.902 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -113.58 123.81 50.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.891 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.9 t70 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.849 -179.978 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.84 0.352 . . . . 54.33 110.856 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -170.94 150.92 3.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.526 0.679 . . . . 52.13 110.936 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 148.99 66.28 Favored 'Trans proline' 0 N--CA 1.465 -0.15 0 C-N-CA 122.729 2.286 . . . . 74.51 112.33 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.29 146.4 61.86 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.616 0.722 . . . . 72.14 111.121 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.87 50.66 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 75.12 112.295 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.4 p90 173.37 148.87 0.22 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 74.31 110.956 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.68 132.38 23.34 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.774 2.316 . . . . 73.43 112.318 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.74 133.79 26.96 Favored 'Cis proline' 0 C--N 1.341 0.153 0 C-N-CA 122.682 -1.799 . . . . 35.14 112.376 -0.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.29 -18.53 50.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 60.3 110.861 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -116.78 125.49 51.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.24 110.905 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 73.55 110.888 179.96 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.814 0.34 . . . . 73.14 110.882 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.1 p90 -170.71 150.88 3.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.548 0.689 . . . . 72.41 110.981 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 149.32 67.08 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.669 2.246 . . . . 74.22 112.363 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.67 146.41 61.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.681 0.753 . . . . 74.32 111.096 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 50.66 0.83 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.706 2.271 . . . . 72.01 112.355 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.2 p90 173.35 148.97 0.22 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.568 0.699 . . . . 75.23 110.971 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.2 Cg_endo -69.87 132.39 23.05 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.66 2.24 . . . . 75.24 112.303 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.2 Cg_endo -69.89 133.85 27.44 Favored 'Cis proline' 0 C--N 1.341 0.158 0 C-N-CA 122.674 -1.802 . . . . 75.34 112.26 0.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -60.34 -18.5 50.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 72.34 110.824 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -117.1 125.58 51.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.846 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 70.14 110.88 179.976 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.494 -0.242 . . . . 45.03 112.494 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m -137.13 123.97 21.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.865 0.364 . . . . 64.15 110.87 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.2 p90 -153.6 153.17 28.65 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.576 0.703 . . . . 74.15 110.945 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 154.24 67.97 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.702 2.268 . . . . 74.51 112.343 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.12 149.63 64.33 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.591 0.71 . . . . 75.2 111.097 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.78 50.06 0.78 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.719 2.279 . . . . 52.3 112.276 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.01 151.92 0.23 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.71 0.767 . . . . 73.21 110.854 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.4 Cg_endo -69.86 131.92 22.08 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.69 2.26 . . . . 60.32 112.281 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.1 Cg_endo -69.68 133.33 25.11 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.688 -1.797 . . . . 71.2 112.356 -0.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -59.86 -18.87 47.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.256 -0.429 . . . . 75.33 110.883 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.8 p90 -120.7 124.11 44.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.174 -0.466 . . . . 72.21 110.886 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -103.95 145.98 29.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.206 -0.452 . . . . 63.42 110.817 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.6 t -161.9 123.41 2.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.112 -0.494 . . . . 75.43 110.909 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.9 ttmm -123.14 72.62 46.59 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.551 0.691 . . . . 74.44 110.851 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 158.38 57.11 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.699 2.266 . . . . 73.31 112.361 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.7 t30 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.25 110.957 -179.995 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.416 -0.274 . . . . 72.53 112.416 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.1 m -136.58 122.37 19.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 52.43 110.904 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -152.56 153.14 30.09 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.524 0.678 . . . . 73.21 110.994 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.82 153.71 68.33 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.66 2.24 . . . . 64.3 112.303 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.67 149.6 65.34 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 72.11 111.153 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.71 50.02 0.76 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.686 2.258 . . . . 73.45 112.352 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.96 151.94 0.23 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.697 0.761 . . . . 73.41 110.925 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.71 131.89 22.26 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.222 . . . . 61.23 112.392 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.7 Cg_endo -69.77 133.29 25.1 Favored 'Cis proline' 0 C--O 1.231 0.138 0 C-N-CA 122.656 -1.81 . . . . 74.11 112.322 -0.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -59.82 -18.81 46.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.474 . . . . 73.12 110.901 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -120.83 124.0 43.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 73.31 110.905 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -103.6 145.35 30.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 73.3 110.83 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.9 t -161.94 123.43 2.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.921 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 21.9 ttpt -158.79 72.97 3.67 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.544 0.687 . . . . 71.22 110.918 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -69.77 143.48 50.95 Favored 'Trans proline' 0 C--O 1.23 0.108 0 C-N-CA 122.698 2.265 . . . . 54.41 112.29 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 65.24 110.923 -179.989 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.436 -0.266 . . . . 71.01 112.436 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.9 m -136.2 125.66 25.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.738 0.304 . . . . 72.35 110.933 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.1 p90 -154.61 153.1 27.28 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.51 0.671 . . . . 75.42 110.917 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 153.73 68.45 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.65 2.233 . . . . 72.45 112.283 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.0 m -137.21 149.78 67.02 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.635 0.731 . . . . 71.14 111.103 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 50.01 0.76 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.654 2.236 . . . . 54.31 112.356 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.98 151.96 0.23 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.621 0.724 . . . . 62.43 110.976 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.0 Cg_endo -69.77 131.84 22.06 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.655 2.237 . . . . 74.41 112.317 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.7 Cg_endo -69.83 133.33 25.34 Favored 'Cis proline' 0 C--N 1.342 0.224 0 C-N-CA 122.667 -1.806 . . . . 72.45 112.307 -0.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -59.79 -18.9 47.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.21 -0.45 . . . . 74.32 110.891 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.4 p90 -120.54 123.41 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.141 -0.481 . . . . 75.54 110.912 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -103.43 146.92 27.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.133 -0.485 . . . . 64.1 110.927 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.6 t -161.98 123.5 2.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.461 . . . . 64.32 110.854 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 tptp -122.33 72.66 38.12 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.558 0.694 . . . . 72.01 110.902 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 154.97 67.05 Favored 'Trans proline' 0 C--O 1.231 0.141 0 C-N-CA 122.672 2.248 . . . . 62.22 112.368 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.409 . . . . 73.35 110.832 -179.994 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 112.406 -0.278 . . . . 52.52 112.406 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.4 m -135.6 126.69 27.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.817 0.342 . . . . 65.44 110.861 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 25.3 p90 -155.47 153.18 26.1 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.517 0.675 . . . . 72.42 110.898 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 154.83 67.11 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.659 2.24 . . . . 75.54 112.388 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 m -138.27 149.66 64.11 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.659 0.742 . . . . 64.4 111.159 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 49.77 0.73 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 72.14 112.341 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.6 p90 173.18 151.92 0.24 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 121.7 0.762 . . . . 64.44 110.937 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.71 131.87 22.2 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.748 2.299 . . . . 74.35 112.319 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.515 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.5 Cg_endo -69.79 133.34 25.3 Favored 'Cis proline' 0 C--O 1.231 0.137 0 C-N-CA 122.695 -1.794 . . . . 75.14 112.307 -0.06 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -59.91 -18.87 48.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 72.52 110.843 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -120.41 123.78 43.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.441 . . . . 73.2 110.896 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -104.3 146.24 29.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.923 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.5 t -161.85 123.38 2.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 73.01 110.867 -179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.1 ttmm -117.73 72.96 8.39 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.608 0.718 . . . . 71.44 110.877 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 154.42 67.72 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.66 2.24 . . . . 64.35 112.348 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.1 t30 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.269 -0.423 . . . . 50.41 110.899 179.991 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 112.517 -0.233 . . . . 53.34 112.517 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.7 m -135.51 122.46 21.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 72.24 110.881 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 24.1 p90 -148.16 152.97 40.73 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.604 0.716 . . . . 74.33 110.905 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 157.91 58.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.696 2.264 . . . . 75.33 112.348 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.27 149.67 61.57 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.637 0.732 . . . . 71.43 111.125 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 50.02 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.662 2.241 . . . . 53.53 112.392 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 173.0 151.37 0.23 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.683 0.754 . . . . 72.33 110.922 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.4 Cg_endo -69.71 131.97 22.44 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.762 2.308 . . . . 74.24 112.328 179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.528 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.66 133.4 25.31 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.677 -1.801 . . . . 71.41 112.38 -0.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.03 -18.88 49.51 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.306 -0.406 . . . . 71.31 110.885 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -117.86 123.52 46.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 75.12 110.882 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -106.48 144.96 32.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.129 -0.487 . . . . 74.42 110.872 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 25.5 t -162.02 123.52 2.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 73.44 110.873 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -113.68 73.64 2.2 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.583 0.706 . . . . 55.0 110.972 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.8 155.22 66.35 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.636 2.224 . . . . 75.54 112.371 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 65.24 110.839 -179.941 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.474 -0.25 . . . . 75.21 112.474 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.9 m -135.51 122.33 21.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.891 0.377 . . . . 72.22 110.87 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 23.2 p90 -147.53 152.94 42.95 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.533 0.682 . . . . 74.54 110.938 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.87 158.33 57.19 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.691 2.261 . . . . 54.14 112.305 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.17 149.78 62.29 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.621 0.724 . . . . 75.11 111.171 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 50.09 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.708 2.272 . . . . 63.13 112.325 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.87 151.38 0.23 Allowed Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.63 0.729 . . . . 73.12 110.956 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.526 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.72 132.01 22.5 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.662 2.242 . . . . 52.41 112.341 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.526 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.42 25.48 Favored 'Cis proline' 0 C--O 1.231 0.167 0 C-N-CA 122.649 -1.813 . . . . 74.11 112.351 -0.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -59.89 -18.86 47.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.24 -0.436 . . . . 73.32 110.929 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -117.53 123.4 46.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.108 -0.496 . . . . 74.11 110.925 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -106.95 145.1 32.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.213 -0.448 . . . . 52.23 110.857 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 29.7 t -161.95 123.47 2.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 74.35 110.899 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 36.2 tttm -113.72 73.81 2.27 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.548 0.689 . . . . 63.03 110.915 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 148.14 64.02 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.66 2.24 . . . . 70.41 112.319 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.152 -0.476 . . . . 64.41 110.906 179.961 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.362 0 N-CA-C 112.474 -0.25 . . . . 65.02 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.8 m -132.74 122.48 24.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.8 0.333 . . . . 64.32 110.924 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 21.0 p90 -147.85 153.08 42.03 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.601 0.715 . . . . 75.35 110.896 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.82 159.69 52.44 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.713 2.276 . . . . 55.54 112.304 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -139.81 149.7 60.16 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.633 0.73 . . . . 74.23 111.154 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 49.99 0.75 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.71 2.273 . . . . 60.44 112.345 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.5 p90 172.94 151.24 0.23 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-O 121.795 0.807 . . . . 74.32 110.869 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.531 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.05 22.39 Favored 'Trans proline' 0 C--N 1.343 0.245 0 C-N-CA 122.638 2.226 . . . . 64.04 112.336 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.8 133.42 25.65 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.619 -1.826 . . . . 72.3 112.353 -0.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -59.97 -19.11 50.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 64.32 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 p90 -116.15 122.59 45.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.108 -0.496 . . . . 74.24 110.889 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -107.36 144.64 33.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 74.3 110.889 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.5 t -161.93 123.72 2.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 74.43 110.924 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -113.37 74.57 2.14 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.541 0.686 . . . . 55.23 110.874 179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 157.77 59.12 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.63 2.22 . . . . 73.24 112.37 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 34.7 t30 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.228 -0.442 . . . . 61.11 110.927 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.386 0 N-CA-C 112.509 -0.236 . . . . 72.3 112.509 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -123.32 140.17 53.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.338 . . . . 75.23 110.851 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.1 151.34 6.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.486 0.66 . . . . 70.22 110.902 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.51 41.78 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.639 2.226 . . . . 71.12 112.364 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -139.98 149.79 60.0 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.604 0.716 . . . . 64.22 111.13 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.77 50.21 0.79 Allowed 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.675 2.25 . . . . 74.23 112.303 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.57 0.22 Allowed Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.667 0.746 . . . . 70.41 110.908 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.85 132.12 22.53 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.647 2.232 . . . . 70.34 112.307 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.0 Cg_endo -69.76 133.61 26.32 Favored 'Cis proline' 0 C--N 1.34 0.131 0 C-N-CA 122.715 -1.785 . . . . 73.3 112.314 -0.007 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 22.9 m-85 -60.0 -18.68 47.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 73.13 110.877 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -113.5 123.7 50.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.118 -0.492 . . . . 72.14 110.919 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -109.69 158.6 17.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.165 -0.47 . . . . 64.54 110.909 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 145.3 21.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.156 -0.474 . . . . 73.23 110.839 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -145.4 70.28 14.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.606 0.717 . . . . 63.14 110.909 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 141.49 45.45 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.668 2.245 . . . . 55.03 112.38 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 45.2 t30 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 74.32 110.933 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.489 -0.244 . . . . 75.43 112.489 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.8 m -124.0 140.15 53.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.868 0.366 . . . . 63.02 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.1 151.37 6.58 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.525 0.678 . . . . 61.32 110.961 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 162.54 41.68 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.704 2.269 . . . . 70.13 112.325 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.01 149.75 59.75 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.607 0.718 . . . . 70.51 111.148 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 50.2 0.79 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.726 2.284 . . . . 72.33 112.32 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.51 0.22 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.73 0.776 . . . . 64.53 110.897 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.542 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.69 132.05 22.62 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.758 2.305 . . . . 63.3 112.33 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.73 133.69 26.54 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.654 -1.811 . . . . 74.51 112.336 -0.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -60.15 -18.56 48.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.291 -0.413 . . . . 73.44 110.862 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.8 p90 -113.45 123.81 50.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 73.2 110.874 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.87 158.62 17.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.476 . . . . 63.52 110.823 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 142.82 19.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 62.52 110.88 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 30.0 tttp -140.55 71.95 31.0 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.74 . . . . 72.04 110.931 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 132.74 24.0 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.696 2.264 . . . . 75.31 112.341 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.214 -0.448 . . . . 72.43 110.878 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.428 -0.269 . . . . 40.33 112.428 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.5 m -124.04 140.21 53.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.828 0.347 . . . . 70.23 110.84 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.11 151.4 6.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.533 0.682 . . . . 61.41 110.922 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 162.63 41.35 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.636 2.224 . . . . 55.24 112.359 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.1 149.74 59.49 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.583 0.706 . . . . 44.5 111.163 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.75 50.18 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.721 2.28 . . . . 72.31 112.354 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.41 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.75 150.49 0.22 Allowed Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.669 0.747 . . . . 71.5 110.908 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.8 Cg_endo -69.75 132.14 22.72 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.619 2.213 . . . . 44.44 112.352 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.2 Cg_endo -69.8 133.66 26.56 Favored 'Cis proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 -1.801 . . . . 74.21 112.332 -0.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -60.09 -18.5 47.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.193 -0.458 . . . . 54.15 110.859 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.53 123.72 50.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.119 -0.491 . . . . 54.35 110.876 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -109.86 158.62 17.99 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 75.21 110.795 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.31 143.86 20.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 73.14 110.863 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -146.43 71.88 12.98 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.599 0.714 . . . . 65.21 110.838 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 153.2 69.29 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.665 2.243 . . . . 71.05 112.324 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.459 . . . . 75.23 110.932 179.982 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.398 -0.281 . . . . 73.14 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.9 m -126.11 140.24 52.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.758 0.313 . . . . 73.54 110.87 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.06 151.47 6.68 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-O 121.656 0.741 . . . . 74.15 110.855 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.83 40.54 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.739 2.293 . . . . 71.35 112.305 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.34 149.73 58.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.63 0.729 . . . . 75.54 111.112 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 50.15 0.78 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.715 2.277 . . . . 75.54 112.337 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.79 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 121.745 0.783 . . . . 74.1 110.882 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.84 132.09 22.47 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.695 2.263 . . . . 61.33 112.311 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.3 Cg_endo -69.79 133.66 26.54 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.67 -1.804 . . . . 74.33 112.33 -0.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -60.04 -18.56 47.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.22 -0.445 . . . . 73.42 110.911 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -113.48 123.7 50.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.17 -0.468 . . . . 54.44 110.906 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -109.83 158.81 17.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.116 -0.493 . . . . 74.24 110.887 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.3 146.8 23.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 72.04 110.862 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -150.98 71.08 8.66 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.599 0.714 . . . . 75.21 110.927 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.77 133.77 26.36 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.681 2.254 . . . . 73.45 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.238 -0.437 . . . . 74.53 110.911 -179.994 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.509 -0.236 . . . . 75.15 112.509 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m -123.54 140.14 53.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.747 0.308 . . . . 74.21 110.946 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.6 p90 -167.17 151.39 6.53 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-O 121.612 0.72 . . . . 75.41 110.92 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 162.6 41.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.675 2.25 . . . . 73.35 112.328 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.0 m -140.03 149.78 59.79 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.605 0.717 . . . . 75.52 111.082 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 50.14 0.78 Allowed 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.6 2.2 . . . . 61.5 112.412 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.408 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.84 150.54 0.22 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.597 0.713 . . . . 73.22 110.964 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.541 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.1 Cg_endo -69.77 132.13 22.66 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.722 2.282 . . . . 74.11 112.343 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 54.5 Cg_endo -69.64 133.69 26.41 Favored 'Cis proline' 0 C--O 1.233 0.23 0 C-N-CA 122.666 -1.806 . . . . 72.05 112.408 -0.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -60.16 -18.56 48.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.274 -0.421 . . . . 73.33 110.898 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -113.5 123.75 50.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 74.14 110.923 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -109.82 158.63 17.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 75.2 110.833 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.33 143.85 20.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 71.13 110.922 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -157.19 69.87 4.43 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.576 0.703 . . . . 62.15 110.865 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 155.06 66.71 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.623 2.215 . . . . 74.24 112.411 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 73.23 110.868 -179.893 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.485 -0.246 . . . . 74.23 112.485 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.7 m -124.71 140.22 53.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 64.53 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -167.19 151.35 6.49 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.556 0.693 . . . . 73.44 110.882 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 162.4 42.18 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.665 2.243 . . . . 71.32 112.425 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.8 60.37 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.612 0.72 . . . . 74.2 111.212 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 50.17 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.734 2.29 . . . . 71.43 112.33 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.5 p90 172.77 150.59 0.22 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.653 0.74 . . . . 74.2 110.948 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.543 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.3 Cg_endo -69.79 132.08 22.53 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.661 2.241 . . . . 73.34 112.336 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.543 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 52.9 Cg_endo -69.83 133.62 26.47 Favored 'Cis proline' 0 C--N 1.342 0.232 0 C-N-CA 122.649 -1.813 . . . . 74.24 112.347 0.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -60.05 -18.53 47.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 74.43 110.876 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -113.53 123.76 50.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.471 . . . . 44.33 110.857 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -109.82 158.54 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 63.45 110.852 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.35 145.18 21.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 74.13 110.869 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 2.8 tttm -146.26 72.0 13.2 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.485 0.66 . . . . 74.3 110.851 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 136.76 33.84 Favored 'Trans proline' 0 N--CA 1.466 -0.131 0 C-N-CA 122.714 2.276 . . . . 73.34 112.355 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.258 -0.428 . . . . 72.24 110.919 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.459 -0.256 . . . . 65.34 112.459 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m -123.56 140.18 53.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.832 0.349 . . . . 63.42 110.938 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.14 151.39 6.56 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 75.14 110.903 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 162.45 42.03 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.663 2.242 . . . . 74.34 112.394 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -139.86 149.78 60.26 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.601 0.715 . . . . 75.33 111.143 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 50.27 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.654 2.236 . . . . 52.43 112.302 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.72 150.58 0.22 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.713 0.768 . . . . 72.22 110.919 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.544 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.9 Cg_endo -69.79 132.14 22.66 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.676 2.251 . . . . 70.13 112.309 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.544 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.3 Cg_endo -69.68 133.55 25.92 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.745 -1.773 . . . . 74.14 112.37 -0.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.01 -18.62 47.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 62.05 110.869 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.5 p90 -113.41 123.61 50.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.901 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -109.67 158.62 17.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.883 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.42 144.84 21.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 71.11 110.814 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -159.3 69.71 3.32 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.49 0.662 . . . . 75.34 110.88 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 151.94 69.41 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.715 2.277 . . . . 75.25 112.346 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.196 -0.457 . . . . 71.53 110.815 -179.973 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 N-CA-C 112.434 -0.266 . . . . 72.53 112.434 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.6 m -134.28 129.53 35.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.806 0.336 . . . . 74.22 110.863 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 15.9 p90 -147.47 151.43 39.82 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.628 0.728 . . . . 60.24 110.892 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 166.96 25.87 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 122.65 2.234 . . . . 63.33 112.393 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.9 m -144.56 149.24 43.14 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.621 0.724 . . . . 65.22 111.121 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 50.28 0.78 Allowed 'Trans proline' 0 C--O 1.233 0.232 0 C-N-CA 122.698 2.265 . . . . 63.11 112.405 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.82 149.95 0.22 Allowed Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.646 0.736 . . . . 75.53 110.957 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.525 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.3 Cg_endo -69.85 132.25 22.79 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.65 2.234 . . . . 75.51 112.335 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.525 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.9 Cg_endo -69.69 133.78 26.84 Favored 'Cis proline' 0 C--N 1.341 0.175 0 C-N-CA 122.713 -1.786 . . . . 64.21 112.359 -0.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 81.5 m-85 -60.24 -18.18 46.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 64.22 110.855 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 p90 -111.98 122.97 49.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 61.52 110.92 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -113.41 94.25 4.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 62.14 110.851 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -108.85 123.26 48.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 64.02 110.888 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 7.7 tttp -161.33 74.15 2.53 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.608 0.718 . . . . 64.54 110.901 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 148.24 64.99 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.64 2.227 . . . . 73.42 112.382 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 75.43 110.894 -179.989 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 N-CA-C 112.446 -0.262 . . . . 73.0 112.446 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.0 m -129.49 123.79 32.38 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.806 0.336 . . . . 73.31 110.899 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.09 151.52 62.29 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-O 121.536 0.684 . . . . 74.2 110.901 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 165.24 31.63 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.662 2.241 . . . . 35.43 112.331 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 m -143.73 149.08 45.42 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.651 0.739 . . . . 61.42 111.142 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 50.41 0.81 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.661 2.241 . . . . 75.12 112.326 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.8 p90 172.82 149.89 0.22 Allowed Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.709 0.766 . . . . 65.3 110.921 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.522 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.1 Cg_endo -69.72 132.11 22.72 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.724 2.283 . . . . 72.51 112.355 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.75 133.68 26.57 Favored 'Cis proline' 0 C--N 1.341 0.152 0 C-N-CA 122.659 -1.809 . . . . 61.43 112.377 -0.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -60.05 -18.45 46.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.47 . . . . 72.14 110.884 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.0 p90 -112.67 123.15 49.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 74.45 110.864 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -111.5 96.06 5.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.877 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.1 t -109.73 123.4 49.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.441 . . . . 74.11 110.867 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 10.2 tptt -113.37 74.71 2.16 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.552 0.691 . . . . 72.12 110.884 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 152.86 69.55 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.666 2.244 . . . . 50.24 112.335 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 18.7 p30 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 61.54 110.895 -179.961 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.256 0 N-CA-C 112.46 -0.256 . . . . 52.15 112.46 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.7 m -135.91 124.03 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.823 0.344 . . . . 61.4 110.925 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 17.6 p90 -141.87 151.37 59.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.591 0.71 . . . . 72.54 110.859 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 165.1 32.03 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.727 2.285 . . . . 71.0 112.335 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 m -143.64 149.02 45.55 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.654 0.74 . . . . 64.23 111.118 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.71 50.37 0.79 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 70.34 112.336 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 5.7 p90 172.83 149.97 0.22 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.661 0.743 . . . . 73.12 110.875 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.523 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.2 Cg_endo -69.72 132.08 22.63 Favored 'Trans proline' 0 C--O 1.232 0.211 0 C-N-CA 122.693 2.262 . . . . 70.53 112.387 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.1 Cg_endo -69.71 133.58 26.1 Favored 'Cis proline' 0 C--O 1.231 0.173 0 C-N-CA 122.725 -1.781 . . . . 75.04 112.349 -0.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -60.07 -18.33 46.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.272 -0.422 . . . . 52.1 110.874 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.4 p90 -112.86 123.2 49.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 75.1 110.908 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -111.54 95.63 5.62 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.477 . . . . 73.0 110.92 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.3 t -109.44 123.42 49.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 75.23 110.892 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.4 ttpp -113.37 74.76 2.17 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.596 0.713 . . . . 62.25 110.894 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 152.25 69.0 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.67 2.247 . . . . 64.45 112.34 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.7 p-10 . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.247 -0.433 . . . . 72.25 110.843 -179.931 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 N-CA-C 112.496 -0.242 . . . . 34.34 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 57.6 m -125.0 140.24 53.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 64.4 110.834 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 19.4 p90 -167.13 151.29 6.51 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.529 0.68 . . . . 74.52 110.966 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.72 162.52 41.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.661 2.241 . . . . 62.22 112.378 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 7' ' ' TYR . 6.1 m -140.0 149.77 59.85 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.629 0.728 . . . . 70.44 111.187 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 50.15 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.705 2.27 . . . . 73.31 112.38 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 5.4 p90 172.8 150.54 0.22 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.626 0.727 . . . . 75.1 110.884 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.71 132.13 22.76 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.679 2.252 . . . . 70.1 112.394 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.8 Cg_endo -69.76 133.62 26.36 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.693 -1.795 . . . . 72.02 112.359 -0.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -60.05 -18.54 47.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.21 -0.45 . . . . 75.15 110.902 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -113.58 123.81 50.85 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.164 -0.471 . . . . 73.32 110.891 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -109.83 158.6 18.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.114 -0.494 . . . . 73.21 110.849 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.7 m -155.28 142.52 19.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.175 -0.466 . . . . 71.41 110.887 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -143.33 70.09 17.83 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.537 0.684 . . . . 74.54 110.891 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.68 149.51 67.5 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.771 2.314 . . . . 71.01 112.365 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.277 -0.42 . . . . 70.41 110.867 -179.998 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.399 0 N-CA-C 112.485 -0.246 . . . . 64.34 112.485 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.2 t -126.78 148.15 49.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.84 0.352 . . . . 54.33 110.856 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.2 p90 -170.94 150.92 3.13 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.526 0.679 . . . . 52.13 110.936 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 148.99 66.28 Favored 'Trans proline' 0 N--CA 1.465 -0.15 0 C-N-CA 122.729 2.286 . . . . 74.51 112.33 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.29 146.4 61.86 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 121.616 0.722 . . . . 72.14 111.121 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.87 50.66 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.699 2.266 . . . . 75.12 112.295 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.4 p90 173.37 148.87 0.22 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 74.31 110.956 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 54.0 Cg_endo -69.68 132.38 23.34 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.774 2.316 . . . . 73.43 112.318 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.6 Cg_endo -69.74 133.79 26.96 Favored 'Cis proline' 0 C--N 1.341 0.153 0 C-N-CA 122.682 -1.799 . . . . 35.14 112.376 -0.118 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -60.29 -18.53 50.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 60.3 110.861 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -116.78 125.49 51.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 73.24 110.905 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -119.81 113.83 21.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.095 -0.502 . . . . 73.55 110.888 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.8 m -120.81 123.7 43.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 73.21 110.923 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -133.3 72.31 75.53 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.591 0.71 . . . . 73.51 110.909 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.7 153.62 68.97 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.676 2.251 . . . . 72.35 112.372 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 73.32 110.871 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.522 -0.231 . . . . 65.03 112.522 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 42.1 t -127.98 147.93 50.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.814 0.34 . . . . 73.14 110.882 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 28.1 p90 -170.71 150.88 3.29 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.548 0.689 . . . . 72.41 110.981 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 149.32 67.08 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.669 2.246 . . . . 74.22 112.363 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.7 m -131.67 146.41 61.75 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.681 0.753 . . . . 74.32 111.096 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 50.66 0.83 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.706 2.271 . . . . 72.01 112.355 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 7.2 p90 173.35 148.97 0.22 Allowed Pre-proline 0 C--N 1.327 -0.38 0 CA-C-O 121.568 0.699 . . . . 75.23 110.971 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.532 ' HA ' ' C ' ' A' ' 9' ' ' PRO . 53.2 Cg_endo -69.87 132.39 23.05 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.66 2.24 . . . . 75.24 112.303 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.532 ' C ' ' HA ' ' A' ' 8' ' ' PRO . 53.2 Cg_endo -69.89 133.85 27.44 Favored 'Cis proline' 0 C--N 1.341 0.158 0 C-N-CA 122.674 -1.802 . . . . 75.34 112.26 0.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -60.34 -18.5 50.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 72.34 110.824 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 11.5 p90 -117.1 125.58 51.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.137 -0.483 . . . . 73.12 110.846 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -119.86 113.88 21.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 70.14 110.88 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 69.4 m -120.73 123.73 43.42 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.175 -0.466 . . . . 74.3 110.963 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -123.7 72.63 52.04 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.544 0.688 . . . . 65.33 110.845 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 145.63 57.83 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.702 2.268 . . . . 75.4 112.359 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 4.3 p30 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 75.34 110.935 179.957 . . . . . . . . 0 0 . 1 stop_ save_