data_1o8z_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 1o8z _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -126.88 141.53 51.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.325 -1.103 . . . . 0.0 110.204 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 95.1 m -118.92 162.45 18.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.201 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.439 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 37.2 p -96.61 165.93 11.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.7 tttt . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.196 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.517 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.225 0.535 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 7' ' ' ILE . 4.4 tt -156.75 93.5 2.36 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.219 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.51 156.2 57.45 Favored 'Cis proline' 0 C--N 1.311 -1.415 0 C-N-CA 121.855 -2.144 . . . . 0.0 110.589 0.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.517 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.43 154.33 59.81 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.7 1.368 . . . . 0.0 110.51 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.4 mm -114.71 139.34 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.233 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 49.9 m -103.47 155.38 18.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.278 -0.889 . . . . 0.0 110.184 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -121.0 159.02 50.94 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.37 -12.95 26.16 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.731 1.385 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.27 -0.894 . . . . 0.0 110.19 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.6 mtt-85 -125.7 141.67 51.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -1.114 . . . . 0.0 110.22 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 84.8 m -125.89 160.59 29.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.217 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -93.23 161.52 14.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 110.199 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.222 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.249 0.547 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.438 ' CA ' ' C ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -172.45 93.23 0.39 Allowed Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.269 -0.894 . . . . 0.0 110.153 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.41 151.04 57.08 Favored 'Cis proline' 0 C--N 1.31 -1.462 0 C-N-CA 121.903 -2.124 . . . . 0.0 110.503 -0.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.57 140.02 84.63 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.724 1.381 . . . . 0.0 110.51 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.9 mt -96.92 136.46 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -0.953 . . . . 0.0 110.202 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.0 153.64 35.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.261 -0.9 . . . . 0.0 110.231 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.8 m-85 -115.84 161.97 27.89 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.897 . . . . 0.0 110.134 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.51 -11.94 22.24 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.709 1.373 . . . . 0.0 110.498 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.4 p30 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.0 110.226 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -99.53 134.06 42.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 46.1 m -126.45 157.98 37.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.208 -0.933 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.416 ' C ' ' HG3' ' A' ' 5' ' ' LYS . 44.1 p -113.75 166.18 11.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.935 . . . . 0.0 110.261 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.416 ' HG3' ' C ' ' A' ' 4' ' ' THR . 54.3 mttm . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.177 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.507 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.261 0.553 . . . . 0.0 110.243 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.491 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -147.1 93.97 4.65 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.201 -0.937 . . . . 0.0 110.199 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.8 161.79 46.97 Favored 'Cis proline' 0 C--N 1.311 -1.433 0 C-N-CA 121.845 -2.148 . . . . 0.0 110.539 -0.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.507 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 157.69 40.52 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.664 1.35 . . . . 0.0 110.533 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.44 HG22 HD11 ' A' ' 10' ' ' ILE . 61.4 mt -111.85 136.37 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.199 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 72.6 m -126.24 150.47 48.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 110.206 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.416 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -109.17 164.72 14.08 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 110.195 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.416 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.43 -16.57 48.26 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.705 1.371 . . . . 0.0 110.59 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.6 p30 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 110.238 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -121.86 147.51 45.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.259 -1.142 . . . . 0.0 110.16 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 88.2 m -128.19 160.82 30.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.231 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -86.65 164.79 16.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.289 -0.882 . . . . 0.0 110.224 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.2 tttt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.182 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.284 0.564 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.448 ' O ' HG21 ' A' ' 7' ' ' ILE . 0.8 OUTLIER -173.24 94.42 0.35 Allowed Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.198 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.8 153.78 61.09 Favored 'Cis proline' 0 C--N 1.311 -1.429 0 C-N-CA 121.883 -2.132 . . . . 0.0 110.542 0.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.433 ' O ' HD12 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -61.18 158.58 34.24 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.747 1.393 . . . . 0.0 110.559 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' O ' ' A' ' 9' ' ' PRO . 27.0 mm -114.04 142.35 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.228 -0.92 . . . . 0.0 110.179 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.3 m -121.97 147.94 45.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.268 -0.895 . . . . 0.0 110.226 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 24.4 m-85 -108.89 161.7 22.71 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 0.0 110.229 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.44 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -13.7 30.82 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.621 1.327 . . . . 0.0 110.499 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 48.1 p30 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 110.196 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 65.3 ttt180 -119.14 140.1 50.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -1.126 . . . . 0.0 110.24 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.7 m -127.1 165.23 19.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.214 -0.929 . . . . 0.0 110.274 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.5 p -107.04 166.94 10.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.341 -0.849 . . . . 0.0 110.211 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.25 -179.95 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' HG21 ' A' ' 7' ' ' ILE . 88.9 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.2 pp -139.14 95.49 9.37 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.193 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.49 165.77 38.21 Favored 'Cis proline' 0 C--N 1.313 -1.337 0 C-N-CA 121.884 -2.132 . . . . 0.0 110.509 -0.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.06 146.53 97.58 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.725 1.381 . . . . 0.0 110.516 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.6 mm -110.51 145.61 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.251 -0.906 . . . . 0.0 110.212 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.36 155.92 32.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.164 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.0 m-85 -115.1 161.59 28.63 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.257 -0.902 . . . . 0.0 110.253 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.23 -12.73 24.71 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.683 1.359 . . . . 0.0 110.593 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.8 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.137 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 49.9 ttp85 -116.13 140.5 49.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -1.153 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 70.1 m -126.0 155.46 41.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 110.229 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.0 p -95.88 169.0 10.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.32 -0.863 . . . . 0.0 110.197 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.161 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.184 0.516 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' PRO . 18.4 mm -149.54 95.17 3.79 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.23 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.2 164.99 39.04 Favored 'Cis proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.908 -2.122 . . . . 0.0 110.517 0.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.39 150.93 78.01 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.743 1.391 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.6 mt -113.28 143.03 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.206 -0.934 . . . . 0.0 110.283 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 68.3 m -119.44 152.59 36.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.223 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.431 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 18.3 m-85 -108.03 159.69 29.62 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.36 -12.2 22.84 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.652 1.343 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.9 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.254 -0.903 . . . . 0.0 110.234 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.446 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 24.4 mmt85 -115.84 141.91 47.47 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.23 -1.159 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.0 m -129.43 158.87 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.196 -0.94 . . . . 0.0 110.187 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.449 HG22 ' HB ' ' A' ' 10' ' ' ILE . 67.8 p -70.89 159.54 34.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 110.235 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 4' ' ' THR . 24.6 mttm . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 30.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.204 0.526 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.506 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.7 mp -139.2 96.59 8.9 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.191 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.82 165.56 35.12 Favored 'Cis proline' 0 C--N 1.312 -1.345 0 C-N-CA 121.939 -2.109 . . . . 0.0 110.541 0.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.466 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.46 150.7 84.01 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.71 1.374 . . . . 0.0 110.505 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.449 ' HB ' HG22 ' A' ' 4' ' ' THR . 64.0 mt -112.17 141.39 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.179 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 52.8 m -121.24 154.33 36.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.273 -0.892 . . . . 0.0 110.244 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.435 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 21.7 m-85 -115.02 161.53 28.78 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.92 . . . . 0.0 110.179 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.33 23.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.714 1.376 . . . . 0.0 110.58 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.7 p30 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.341 -0.849 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -115.4 149.53 37.83 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.263 -1.139 . . . . 0.0 110.153 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 20.6 m -127.41 156.11 42.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 110.213 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -27.81 63.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.178 -0.951 . . . . 0.0 110.287 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.44 ' HE3' ' CG ' ' A' ' 9' ' ' PRO . 21.9 mttt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.264 0.554 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.4 mt -139.27 95.56 9.22 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.91 . . . . 0.0 110.275 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.43 166.06 36.97 Favored 'Cis proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.886 -2.131 . . . . 0.0 110.602 0.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.44 ' CG ' ' HE3' ' A' ' 5' ' ' LYS . 3.0 Cg_exo -60.7 156.49 42.46 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.666 1.351 . . . . 0.0 110.483 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.4 mt -115.39 140.05 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 99.0 m -122.35 158.64 29.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.0 110.233 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.443 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 16.8 m-85 -116.27 159.23 40.6 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.288 -0.883 . . . . 0.0 110.162 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.94 -13.38 26.93 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.699 1.368 . . . . 0.0 110.505 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.443 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.7 p30 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.224 -0.923 . . . . 0.0 110.193 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 73.5 mtt85 -124.97 136.86 54.13 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.242 -1.152 . . . . 0.0 110.222 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.5 m -125.41 158.85 33.3 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.174 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.479 ' CB ' ' OG ' ' A' ' 6' ' ' SER . 32.2 p -86.82 160.65 18.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.23 -0.919 . . . . 0.0 110.207 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.4 mttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.257 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.479 ' OG ' ' CB ' ' A' ' 4' ' ' THR . 7.4 m . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.256 0.55 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 35.7 mm -147.66 96.11 4.16 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.181 -0.949 . . . . 0.0 110.249 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.8 Cg_endo -62.47 166.93 34.46 Favored 'Cis proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.925 -2.115 . . . . 0.0 110.661 -0.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.8 153.52 62.19 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 O-C-N 123.734 1.387 . . . . 0.0 110.498 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.438 ' O ' HG22 ' A' ' 4' ' ' THR . 71.2 mt -117.98 134.13 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.221 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 13.6 m -103.88 162.47 13.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 110.133 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.0 m-85 -124.19 154.62 68.57 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.193 -0.942 . . . . 0.0 110.18 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.75 -15.37 37.21 Favored 'Trans proline' 0 C--N 1.311 -1.417 0 O-C-N 123.727 1.383 . . . . 0.0 110.546 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 41.6 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.275 -0.89 . . . . 0.0 110.139 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 36.7 ttt180 -112.23 138.09 49.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.203 -1.175 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 16.7 m -122.98 158.48 30.39 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.88 . . . . 0.0 110.25 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.4 p -112.76 168.34 9.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.359 -0.838 . . . . 0.0 110.219 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 24.4 mttm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.524 ' O ' ' CG2' ' A' ' 7' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.276 0.56 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.524 ' CG2' ' O ' ' A' ' 6' ' ' SER . 1.1 pp -156.51 97.51 2.17 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.424 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.89 158.38 56.54 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.979 -2.092 . . . . 0.0 110.606 -0.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HB3' ' O ' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.25 157.36 40.51 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.745 1.392 . . . . 0.0 110.603 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.3 mt -121.6 131.43 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.217 -0.927 . . . . 0.0 110.206 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 95.2 m -117.63 156.84 27.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.244 -0.91 . . . . 0.0 110.251 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.449 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.4 m-85 -111.99 161.97 23.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.205 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -12.66 25.29 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.671 1.353 . . . . 0.0 110.568 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 46.0 p30 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.88 . . . . 0.0 110.13 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.497 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 56.9 mtm-85 -127.9 133.37 49.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.232 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -110.42 151.68 27.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.929 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.488 ' O ' ' CG ' ' A' ' 5' ' ' LYS . 60.2 p -85.54 175.84 8.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.207 -0.933 . . . . 0.0 110.201 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' A' ' 4' ' ' THR . 32.7 mttt . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.212 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.508 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 74.4 p . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.215 0.531 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.44 ' O ' HG12 ' A' ' 7' ' ' ILE . 2.3 tt -156.74 94.59 2.28 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.435 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.22 153.49 56.95 Favored 'Cis proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.935 -2.11 . . . . 0.0 110.594 -0.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.508 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.46 156.5 46.32 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.682 1.359 . . . . 0.0 110.572 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 85.7 mt -125.13 133.14 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.177 -0.952 . . . . 0.0 110.204 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 6.6 t -117.39 162.52 17.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.337 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.7 m-85 -116.8 162.05 29.16 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.235 -0.915 . . . . 0.0 110.226 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.33 -15.47 40.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.716 1.377 . . . . 0.0 110.444 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 50.0 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.116 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 47.1 mtm180 -122.46 138.88 54.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.196 -1.179 . . . . 0.0 110.213 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -120.58 161.03 22.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.16 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -29.99 70.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.276 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 57.0 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.288 0.566 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.516 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.4 tp -146.84 96.34 4.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.257 -0.902 . . . . 0.0 110.217 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.3 164.47 35.55 Favored 'Cis proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.889 -2.13 . . . . 0.0 110.671 0.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -60.92 160.27 26.17 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.64 1.337 . . . . 0.0 110.565 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.9 mm -112.31 136.7 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 110.264 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.3 m -118.62 159.53 23.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 110.199 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -125.89 159.11 63.17 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.76 -11.72 22.04 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.654 1.344 . . . . 0.0 110.551 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' A' ' 2' ' ' ARG . 52.8 p30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.152 -0.968 . . . . 0.0 110.18 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.415 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 79.1 mtt85 -117.11 109.93 17.55 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -1.138 . . . . 0.0 110.177 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 56.1 m -101.83 147.74 26.14 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.935 . . . . 0.0 110.319 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.4 p -87.52 -178.11 6.05 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.356 -0.84 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.4 mttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.241 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.282 0.563 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.9 tt -173.13 93.87 0.36 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.908 . . . . 0.0 110.16 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -60.02 158.32 43.96 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.843 -2.149 . . . . 0.0 110.615 0.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.68 150.1 87.11 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.733 1.386 . . . . 0.0 110.617 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm -111.43 134.05 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.319 -0.863 . . . . 0.0 110.135 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.6 t -137.25 151.44 48.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.261 -0.9 . . . . 0.0 110.292 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -104.47 165.37 13.44 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 0.0 110.196 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.459 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.74 -11.85 22.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.741 1.39 . . . . 0.0 110.48 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.465 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 34.4 p-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.202 -0.936 . . . . 0.0 110.251 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 77.5 mtt85 -115.44 148.48 39.35 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.26 -1.141 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.2 m -135.17 156.81 48.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.265 -0.897 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -68.58 -32.98 73.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.254 -0.904 . . . . 0.0 110.221 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 tttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.224 179.951 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.202 0.525 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -171.55 92.82 0.42 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 110.144 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -60.09 157.06 46.62 Favored 'Cis proline' 0 C--N 1.31 -1.457 0 C-N-CA 121.834 -2.152 . . . . 0.0 110.573 0.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.19 151.08 81.35 Favored 'Trans proline' 0 C--N 1.312 -1.35 0 O-C-N 123.688 1.362 . . . . 0.0 110.733 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.6 tt -126.12 159.41 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.0 110.129 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 55.3 m -122.74 138.86 54.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.194 -0.942 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 41.2 m-85 -94.87 163.77 21.31 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.917 . . . . 0.0 110.25 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.56 -16.12 45.9 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.755 1.397 . . . . 0.0 110.554 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.4 p30 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.288 -0.883 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -118.37 142.72 47.25 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -1.127 . . . . 0.0 110.118 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -125.53 153.05 44.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.293 -0.879 . . . . 0.0 110.173 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.492 ' OG1' ' N ' ' A' ' 6' ' ' SER . 69.8 p -71.58 166.81 21.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.269 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.6 tttt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.517 ' N ' ' HA ' ' A' ' 9' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.221 0.534 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.523 ' O ' ' CG2' ' A' ' 7' ' ' ILE . 7.0 tp -157.61 100.46 1.86 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.285 -0.885 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.417 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.95 156.03 60.87 Favored 'Cis proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.688 0.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.517 ' HA ' ' N ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.78 164.41 16.29 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.794 1.418 . . . . 0.0 110.551 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.3 mt -122.83 137.67 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.316 -0.865 . . . . 0.0 110.191 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.4 m -115.47 155.01 28.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.419 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 44.9 m-85 -118.55 164.3 21.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.222 -0.924 . . . . 0.0 110.143 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.38 24.01 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.641 1.338 . . . . 0.0 110.556 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.8 p30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.916 . . . . 0.0 110.223 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.0 ttt180 -127.56 135.98 51.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -1.092 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.3 m -123.31 151.43 42.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.418 ' HB ' ' OG ' ' A' ' 6' ' ' SER . 65.6 p -54.81 -44.69 74.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.261 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.225 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.205 0.526 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.509 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.7 tp -149.38 95.54 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.274 -0.891 . . . . 0.0 110.204 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.72 164.07 39.3 Favored 'Cis proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.882 -2.133 . . . . 0.0 110.611 0.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.33 149.6 88.68 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.773 1.407 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.6 mt -118.06 136.1 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.23 -0.919 . . . . 0.0 110.24 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 m -110.81 159.02 18.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.193 -0.942 . . . . 0.0 110.132 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.406 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 41.1 m-85 -125.45 159.96 57.81 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.305 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 -13.04 26.86 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.662 1.348 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -133.32 134.64 44.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.263 -1.139 . . . . 0.0 110.309 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 1.8 m -103.78 148.6 25.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.283 -0.885 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 5' ' ' LYS . 33.7 p -83.41 169.13 15.9 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.185 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 4' ' ' THR . 98.4 mttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.167 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.424 ' O ' ' NZ ' ' A' ' 5' ' ' LYS . 18.1 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.342 0.591 . . . . 0.0 110.16 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.1 tp -162.49 93.55 1.25 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.168 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.97 162.65 45.34 Favored 'Cis proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.851 -2.145 . . . . 0.0 110.6 -0.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.82 151.6 69.82 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.605 1.318 . . . . 0.0 110.551 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.421 HG13 ' N ' ' A' ' 11' ' ' CYS . 9.5 tp -118.38 162.56 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.1 OUTLIER -116.22 137.64 51.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 110.247 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.1 m-85 -83.87 161.81 54.47 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.235 -0.916 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -60.8 -12.46 21.98 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 123.68 1.358 . . . . 0.0 110.563 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.2 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 110.258 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.416 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 25.6 ttt85 -88.16 95.91 10.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -1.171 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.497 ' HA ' ' CB ' ' A' ' 11' ' ' CYS . 40.2 m -103.72 148.2 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -0.902 . . . . 0.0 110.179 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.5 p -113.0 170.65 8.05 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.178 -0.951 . . . . 0.0 110.261 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 tttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.247 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.457 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 58.8 m . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.389 0.614 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.464 ' N ' ' O ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -141.19 95.62 7.39 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.196 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -62.08 162.6 46.19 Favored 'Cis proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.923 -2.116 . . . . 0.0 110.548 -0.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.457 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 150.86 83.58 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.646 1.34 . . . . 0.0 110.555 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.5 mt -123.85 139.44 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.944 . . . . 0.0 110.206 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.497 ' CB ' ' HA ' ' A' ' 3' ' ' CYS . 51.4 t -131.31 157.49 43.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 110.234 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.402 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.6 m-85 -104.22 164.55 15.06 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.211 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.41 -17.54 54.04 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.635 1.334 . . . . 0.0 110.543 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.906 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.445 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 94.2 mtt-85 -118.74 144.39 46.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.174 -1.192 . . . . 0.0 110.12 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.2 m -132.15 153.86 50.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.462 ' CB ' ' HB3' ' A' ' 6' ' ' SER . 57.9 p -51.1 -44.37 61.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.208 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 52.7 tttm . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.207 179.986 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.462 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 1.4 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.285 0.564 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.473 HG22 HD11 ' A' ' 7' ' ' ILE . 29.6 mt -154.19 96.75 2.66 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.341 -0.849 . . . . 0.0 110.22 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.7 150.87 65.72 Favored 'Cis proline' 0 C--N 1.312 -1.358 0 C-N-CA 121.953 -2.103 . . . . 0.0 110.584 -0.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -62.15 154.02 65.56 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.613 1.323 . . . . 0.0 110.509 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mt -118.58 143.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -0.898 . . . . 0.0 110.175 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 17.5 m -125.04 150.6 46.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.296 -0.878 . . . . 0.0 110.215 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.458 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 23.9 m-85 -112.76 160.87 29.07 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.273 -0.892 . . . . 0.0 110.29 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.49 -15.46 41.34 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.66 1.347 . . . . 0.0 110.608 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.458 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 50.0 p30 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.268 -0.895 . . . . 0.0 110.219 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -117.75 146.79 43.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -1.147 . . . . 0.0 110.202 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -130.86 160.17 35.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 110.172 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.444 ' OG1' ' N ' ' A' ' 6' ' ' SER . 34.6 p -87.27 -179.49 6.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.293 -0.879 . . . . 0.0 110.344 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 35.7 tttm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.172 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.504 ' CB ' HG12 ' A' ' 10' ' ' ILE . 1.8 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.264 0.554 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.462 HG21 ' O ' ' A' ' 6' ' ' SER . 7.0 pt -143.94 101.54 4.93 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.276 -0.89 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -63.4 148.96 66.13 Favored 'Cis proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.127 -2.03 . . . . 0.0 110.536 -0.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HA ' ' C ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -62.88 152.68 77.67 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.688 1.362 . . . . 0.0 110.56 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.504 HG12 ' CB ' ' A' ' 6' ' ' SER . 29.2 mm -109.46 136.36 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.08 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.8 m -121.96 148.68 44.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.882 . . . . 0.0 110.218 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.43 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 28.6 m-85 -109.54 165.04 13.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.56 -12.84 26.38 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.724 1.381 . . . . 0.0 110.579 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.6 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.256 -0.903 . . . . 0.0 110.162 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -126.88 141.53 51.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.325 -1.103 . . . . 0.0 110.204 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 95.1 m -118.92 162.45 18.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.201 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.439 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 37.2 p -96.61 165.93 11.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.7 tttt . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.196 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.517 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.225 0.535 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 7' ' ' ILE . 4.4 tt -156.75 93.5 2.36 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.219 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.51 156.2 57.45 Favored 'Cis proline' 0 C--N 1.311 -1.415 0 C-N-CA 121.855 -2.144 . . . . 0.0 110.589 0.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.517 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.43 154.33 59.81 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.7 1.368 . . . . 0.0 110.51 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.4 mm -114.71 139.34 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.233 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 49.9 m -103.47 155.38 18.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.278 -0.889 . . . . 0.0 110.184 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -121.0 159.02 50.94 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.37 -12.95 26.16 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.731 1.385 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.27 -0.894 . . . . 0.0 110.19 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.6 mtt-85 -125.7 141.67 51.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -1.114 . . . . 0.0 110.22 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 84.8 m -125.89 160.59 29.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.217 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -93.23 161.52 14.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 110.199 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.222 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.249 0.547 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.438 ' CA ' ' C ' ' A' ' 8' ' ' PRO . 0.5 OUTLIER -172.45 93.23 0.39 Allowed Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.269 -0.894 . . . . 0.0 110.153 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.41 151.04 57.08 Favored 'Cis proline' 0 C--N 1.31 -1.462 0 C-N-CA 121.903 -2.124 . . . . 0.0 110.503 -0.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.57 140.02 84.63 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.724 1.381 . . . . 0.0 110.51 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.9 mt -96.92 136.46 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -0.953 . . . . 0.0 110.202 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.0 153.64 35.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.261 -0.9 . . . . 0.0 110.231 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.8 m-85 -115.84 161.97 27.89 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.897 . . . . 0.0 110.134 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.451 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.51 -11.94 22.24 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.709 1.373 . . . . 0.0 110.498 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.4 p30 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.0 110.226 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -99.53 134.06 42.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 46.1 m -126.45 157.98 37.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.208 -0.933 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.416 ' C ' ' HG3' ' A' ' 5' ' ' LYS . 44.1 p -113.75 166.18 11.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.935 . . . . 0.0 110.261 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.416 ' HG3' ' C ' ' A' ' 4' ' ' THR . 54.3 mttm . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.177 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.507 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.261 0.553 . . . . 0.0 110.243 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.491 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -147.1 93.97 4.65 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.201 -0.937 . . . . 0.0 110.199 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.8 161.79 46.97 Favored 'Cis proline' 0 C--N 1.311 -1.433 0 C-N-CA 121.845 -2.148 . . . . 0.0 110.539 -0.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.507 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 157.69 40.52 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.664 1.35 . . . . 0.0 110.533 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.44 HG22 HD11 ' A' ' 10' ' ' ILE . 61.4 mt -111.85 136.37 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.199 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 72.6 m -126.24 150.47 48.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 110.206 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.416 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -109.17 164.72 14.08 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 110.195 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.416 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.43 -16.57 48.26 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.705 1.371 . . . . 0.0 110.59 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.6 p30 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 110.238 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -121.86 147.51 45.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.259 -1.142 . . . . 0.0 110.16 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 88.2 m -128.19 160.82 30.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.231 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -86.65 164.79 16.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.289 -0.882 . . . . 0.0 110.224 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.2 tttt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.182 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.284 0.564 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.448 ' O ' HG21 ' A' ' 7' ' ' ILE . 0.8 OUTLIER -173.24 94.42 0.35 Allowed Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.198 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.8 153.78 61.09 Favored 'Cis proline' 0 C--N 1.311 -1.429 0 C-N-CA 121.883 -2.132 . . . . 0.0 110.542 0.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.433 ' O ' HD12 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -61.18 158.58 34.24 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.747 1.393 . . . . 0.0 110.559 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' O ' ' A' ' 9' ' ' PRO . 27.0 mm -114.04 142.35 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.228 -0.92 . . . . 0.0 110.179 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 65.3 m -121.97 147.94 45.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.268 -0.895 . . . . 0.0 110.226 179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 24.4 m-85 -108.89 161.7 22.71 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 0.0 110.229 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.44 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -13.7 30.82 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.621 1.327 . . . . 0.0 110.499 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 48.1 p30 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 110.196 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 65.3 ttt180 -119.14 140.1 50.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -1.126 . . . . 0.0 110.24 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.7 m -127.1 165.23 19.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.214 -0.929 . . . . 0.0 110.274 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.5 p -107.04 166.94 10.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.341 -0.849 . . . . 0.0 110.211 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.25 -179.95 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' HG21 ' A' ' 7' ' ' ILE . 88.9 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.2 pp -139.14 95.49 9.37 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.193 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.49 165.77 38.21 Favored 'Cis proline' 0 C--N 1.313 -1.337 0 C-N-CA 121.884 -2.132 . . . . 0.0 110.509 -0.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.06 146.53 97.58 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.725 1.381 . . . . 0.0 110.516 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.6 mm -110.51 145.61 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.251 -0.906 . . . . 0.0 110.212 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.36 155.92 32.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.164 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.0 m-85 -115.1 161.59 28.63 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.257 -0.902 . . . . 0.0 110.253 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.23 -12.73 24.71 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.683 1.359 . . . . 0.0 110.593 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.8 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.137 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 49.9 ttp85 -116.13 140.5 49.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -1.153 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 70.1 m -126.0 155.46 41.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 110.229 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.0 p -95.88 169.0 10.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.32 -0.863 . . . . 0.0 110.197 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.161 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.184 0.516 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' PRO . 18.4 mm -149.54 95.17 3.79 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.23 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.2 164.99 39.04 Favored 'Cis proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.908 -2.122 . . . . 0.0 110.517 0.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.39 150.93 78.01 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.743 1.391 . . . . 0.0 110.551 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.6 mt -113.28 143.03 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.206 -0.934 . . . . 0.0 110.283 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 68.3 m -119.44 152.59 36.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.223 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.431 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 18.3 m-85 -108.03 159.69 29.62 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.36 -12.2 22.84 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.652 1.343 . . . . 0.0 110.521 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.9 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.254 -0.903 . . . . 0.0 110.234 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.446 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 24.4 mmt85 -115.84 141.91 47.47 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.23 -1.159 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.0 m -129.43 158.87 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.196 -0.94 . . . . 0.0 110.187 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.449 HG22 ' HB ' ' A' ' 10' ' ' ILE . 67.8 p -70.89 159.54 34.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 110.235 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 4' ' ' THR . 24.6 mttm . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.466 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 30.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.204 0.526 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.506 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.7 mp -139.2 96.59 8.9 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.191 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.82 165.56 35.12 Favored 'Cis proline' 0 C--N 1.312 -1.345 0 C-N-CA 121.939 -2.109 . . . . 0.0 110.541 0.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.466 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.46 150.7 84.01 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.71 1.374 . . . . 0.0 110.505 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.449 ' HB ' HG22 ' A' ' 4' ' ' THR . 64.0 mt -112.17 141.39 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.179 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 52.8 m -121.24 154.33 36.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.273 -0.892 . . . . 0.0 110.244 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.435 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 21.7 m-85 -115.02 161.53 28.78 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.92 . . . . 0.0 110.179 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.33 23.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.714 1.376 . . . . 0.0 110.58 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.7 p30 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.341 -0.849 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -115.4 149.53 37.83 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.263 -1.139 . . . . 0.0 110.153 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 20.6 m -127.41 156.11 42.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 110.213 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -27.81 63.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.178 -0.951 . . . . 0.0 110.287 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.44 ' HE3' ' CG ' ' A' ' 9' ' ' PRO . 21.9 mttt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.457 ' O ' HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.264 0.554 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.4 mt -139.27 95.56 9.22 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.91 . . . . 0.0 110.275 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.43 166.06 36.97 Favored 'Cis proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.886 -2.131 . . . . 0.0 110.602 0.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.44 ' CG ' ' HE3' ' A' ' 5' ' ' LYS . 3.0 Cg_exo -60.7 156.49 42.46 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.666 1.351 . . . . 0.0 110.483 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.4 mt -115.39 140.05 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 99.0 m -122.35 158.64 29.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.0 110.233 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.443 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 16.8 m-85 -116.27 159.23 40.6 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.288 -0.883 . . . . 0.0 110.162 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.94 -13.38 26.93 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.699 1.368 . . . . 0.0 110.505 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.443 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.7 p30 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.224 -0.923 . . . . 0.0 110.193 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 73.5 mtt85 -124.97 136.86 54.13 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.242 -1.152 . . . . 0.0 110.222 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.5 m -125.41 158.85 33.3 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.174 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.479 ' CB ' ' OG ' ' A' ' 6' ' ' SER . 32.2 p -86.82 160.65 18.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.23 -0.919 . . . . 0.0 110.207 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.4 mttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.257 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.479 ' OG ' ' CB ' ' A' ' 4' ' ' THR . 7.4 m . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.256 0.55 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 35.7 mm -147.66 96.11 4.16 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.181 -0.949 . . . . 0.0 110.249 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.8 Cg_endo -62.47 166.93 34.46 Favored 'Cis proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.925 -2.115 . . . . 0.0 110.661 -0.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.8 153.52 62.19 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 O-C-N 123.734 1.387 . . . . 0.0 110.498 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.438 ' O ' HG22 ' A' ' 4' ' ' THR . 71.2 mt -117.98 134.13 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.221 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 13.6 m -103.88 162.47 13.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 110.133 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.0 m-85 -124.19 154.62 68.57 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.193 -0.942 . . . . 0.0 110.18 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.75 -15.37 37.21 Favored 'Trans proline' 0 C--N 1.311 -1.417 0 O-C-N 123.727 1.383 . . . . 0.0 110.546 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 41.6 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.275 -0.89 . . . . 0.0 110.139 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 36.7 ttt180 -112.23 138.09 49.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.203 -1.175 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 16.7 m -122.98 158.48 30.39 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.88 . . . . 0.0 110.25 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.4 p -112.76 168.34 9.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.359 -0.838 . . . . 0.0 110.219 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 24.4 mttm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.524 ' O ' ' CG2' ' A' ' 7' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.276 0.56 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.524 ' CG2' ' O ' ' A' ' 6' ' ' SER . 1.1 pp -156.51 97.51 2.17 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.89 158.38 56.54 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.979 -2.092 . . . . 0.0 110.606 -0.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HB3' ' O ' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.25 157.36 40.51 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.745 1.392 . . . . 0.0 110.603 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.3 mt -121.6 131.43 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.217 -0.927 . . . . 0.0 110.206 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 95.2 m -117.63 156.84 27.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.244 -0.91 . . . . 0.0 110.251 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.449 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.4 m-85 -111.99 161.97 23.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.205 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -12.66 25.29 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.671 1.353 . . . . 0.0 110.568 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 46.0 p30 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.88 . . . . 0.0 110.13 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 56.9 mtm-85 -127.9 133.37 49.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.232 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -110.42 151.68 27.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.929 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.488 ' O ' ' CG ' ' A' ' 5' ' ' LYS . 60.2 p -85.54 175.84 8.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.207 -0.933 . . . . 0.0 110.201 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' A' ' 4' ' ' THR . 32.7 mttt . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.212 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.508 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 74.4 p . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.215 0.531 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.44 ' O ' HG12 ' A' ' 7' ' ' ILE . 2.3 tt -156.74 94.59 2.28 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.435 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.22 153.49 56.95 Favored 'Cis proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.935 -2.11 . . . . 0.0 110.594 -0.037 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.508 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.46 156.5 46.32 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.682 1.359 . . . . 0.0 110.572 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 85.7 mt -125.13 133.14 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.177 -0.952 . . . . 0.0 110.204 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 6.6 t -117.39 162.52 17.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.337 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.7 m-85 -116.8 162.05 29.16 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.235 -0.915 . . . . 0.0 110.226 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.33 -15.47 40.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.716 1.377 . . . . 0.0 110.444 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 50.0 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.116 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 47.1 mtm180 -122.46 138.88 54.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.196 -1.179 . . . . 0.0 110.213 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -120.58 161.03 22.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.16 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -29.99 70.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.276 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 57.0 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.288 0.566 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.516 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.4 tp -146.84 96.34 4.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.257 -0.902 . . . . 0.0 110.217 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.3 164.47 35.55 Favored 'Cis proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.889 -2.13 . . . . 0.0 110.671 0.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -60.92 160.27 26.17 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.64 1.337 . . . . 0.0 110.565 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.9 mm -112.31 136.7 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 110.264 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.3 m -118.62 159.53 23.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 110.199 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -125.89 159.11 63.17 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.76 -11.72 22.04 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.654 1.344 . . . . 0.0 110.551 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' A' ' 2' ' ' ARG . 52.8 p30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.152 -0.968 . . . . 0.0 110.18 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 79.1 mtt85 -117.11 109.93 17.55 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -1.138 . . . . 0.0 110.177 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 56.1 m -101.83 147.74 26.14 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.935 . . . . 0.0 110.319 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.4 p -87.52 -178.11 6.05 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.356 -0.84 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.4 mttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.241 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.282 0.563 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.9 tt -173.13 93.87 0.36 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.908 . . . . 0.0 110.16 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -60.02 158.32 43.96 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.843 -2.149 . . . . 0.0 110.615 0.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.68 150.1 87.11 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.733 1.386 . . . . 0.0 110.617 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm -111.43 134.05 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.319 -0.863 . . . . 0.0 110.135 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 8.6 t -137.25 151.44 48.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.261 -0.9 . . . . 0.0 110.292 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -104.47 165.37 13.44 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 0.0 110.196 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.459 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.74 -11.85 22.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.741 1.39 . . . . 0.0 110.48 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.465 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 34.4 p-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.202 -0.936 . . . . 0.0 110.251 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 77.5 mtt85 -115.44 148.48 39.35 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.26 -1.141 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.2 m -135.17 156.81 48.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.265 -0.897 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -68.58 -32.98 73.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.254 -0.904 . . . . 0.0 110.221 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 tttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.224 179.951 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.202 0.525 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -171.55 92.82 0.42 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 110.144 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -60.09 157.06 46.62 Favored 'Cis proline' 0 C--N 1.31 -1.457 0 C-N-CA 121.834 -2.152 . . . . 0.0 110.573 0.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.19 151.08 81.35 Favored 'Trans proline' 0 C--N 1.312 -1.35 0 O-C-N 123.688 1.362 . . . . 0.0 110.733 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.6 tt -126.12 159.41 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.0 110.129 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 55.3 m -122.74 138.86 54.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.194 -0.942 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 41.2 m-85 -94.87 163.77 21.31 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.917 . . . . 0.0 110.25 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.56 -16.12 45.9 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.755 1.397 . . . . 0.0 110.554 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.4 p30 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.288 -0.883 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -118.37 142.72 47.25 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -1.127 . . . . 0.0 110.118 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -125.53 153.05 44.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.293 -0.879 . . . . 0.0 110.173 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.492 ' OG1' ' N ' ' A' ' 6' ' ' SER . 69.8 p -71.58 166.81 21.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.269 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.6 tttt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.517 ' N ' ' HA ' ' A' ' 9' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.221 0.534 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.523 ' O ' ' CG2' ' A' ' 7' ' ' ILE . 7.0 tp -157.61 100.46 1.86 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.285 -0.885 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.417 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.95 156.03 60.87 Favored 'Cis proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.688 0.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.517 ' HA ' ' N ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.78 164.41 16.29 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.794 1.418 . . . . 0.0 110.551 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.3 mt -122.83 137.67 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.316 -0.865 . . . . 0.0 110.191 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.4 m -115.47 155.01 28.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.419 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 44.9 m-85 -118.55 164.3 21.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.222 -0.924 . . . . 0.0 110.143 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.38 24.01 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.641 1.338 . . . . 0.0 110.556 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.8 p30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.916 . . . . 0.0 110.223 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.0 ttt180 -127.56 135.98 51.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -1.092 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.3 m -123.31 151.43 42.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.418 ' HB ' ' OG ' ' A' ' 6' ' ' SER . 65.6 p -54.81 -44.69 74.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.261 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.225 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.205 0.526 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.509 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.7 tp -149.38 95.54 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.274 -0.891 . . . . 0.0 110.204 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.72 164.07 39.3 Favored 'Cis proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.882 -2.133 . . . . 0.0 110.611 0.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.33 149.6 88.68 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.773 1.407 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.6 mt -118.06 136.1 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.23 -0.919 . . . . 0.0 110.24 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 m -110.81 159.02 18.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.193 -0.942 . . . . 0.0 110.132 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.406 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 41.1 m-85 -125.45 159.96 57.81 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.305 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 -13.04 26.86 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.662 1.348 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -133.32 134.64 44.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.263 -1.139 . . . . 0.0 110.309 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 1.8 m -103.78 148.6 25.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.283 -0.885 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 5' ' ' LYS . 33.7 p -83.41 169.13 15.9 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.185 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 4' ' ' THR . 98.4 mttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.167 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.424 ' O ' ' NZ ' ' A' ' 5' ' ' LYS . 18.1 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.342 0.591 . . . . 0.0 110.16 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.1 tp -162.49 93.55 1.25 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.168 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.97 162.65 45.34 Favored 'Cis proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.851 -2.145 . . . . 0.0 110.6 -0.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.82 151.6 69.82 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.605 1.318 . . . . 0.0 110.551 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.421 HG13 ' N ' ' A' ' 11' ' ' CYS . 9.5 tp -118.38 162.56 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 0.1 OUTLIER -116.22 137.64 51.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 110.247 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.459 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.1 m-85 -83.87 161.81 54.47 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.235 -0.916 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -60.8 -12.46 21.98 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 123.68 1.358 . . . . 0.0 110.563 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.459 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.2 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 110.258 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.416 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 25.6 ttt85 -88.16 95.91 10.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -1.171 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.497 ' HA ' ' CB ' ' A' ' 11' ' ' CYS . 40.2 m -103.72 148.2 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -0.902 . . . . 0.0 110.179 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.5 p -113.0 170.65 8.05 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.178 -0.951 . . . . 0.0 110.261 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 tttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.247 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.457 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 58.8 m . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.389 0.614 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.464 ' N ' ' O ' ' A' ' 8' ' ' PRO . 0.9 OUTLIER -141.19 95.62 7.39 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.196 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -62.08 162.6 46.19 Favored 'Cis proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.923 -2.116 . . . . 0.0 110.548 -0.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.457 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 150.86 83.58 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.646 1.34 . . . . 0.0 110.555 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.5 mt -123.85 139.44 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.944 . . . . 0.0 110.206 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.497 ' CB ' ' HA ' ' A' ' 3' ' ' CYS . 51.4 t -131.31 157.49 43.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 110.234 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.402 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.6 m-85 -104.22 164.55 15.06 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.211 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.41 -17.54 54.04 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.635 1.334 . . . . 0.0 110.543 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.906 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.445 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 94.2 mtt-85 -118.74 144.39 46.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.174 -1.192 . . . . 0.0 110.12 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.2 m -132.15 153.86 50.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.462 ' CB ' ' HB3' ' A' ' 6' ' ' SER . 57.9 p -51.1 -44.37 61.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.208 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 52.7 tttm . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.207 179.986 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.462 ' HB3' ' CB ' ' A' ' 4' ' ' THR . 1.4 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.285 0.564 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.473 HG22 HD11 ' A' ' 7' ' ' ILE . 29.6 mt -154.19 96.75 2.66 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.341 -0.849 . . . . 0.0 110.22 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.7 150.87 65.72 Favored 'Cis proline' 0 C--N 1.312 -1.358 0 C-N-CA 121.953 -2.103 . . . . 0.0 110.584 -0.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -62.15 154.02 65.56 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.613 1.323 . . . . 0.0 110.509 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 51.6 mt -118.58 143.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -0.898 . . . . 0.0 110.175 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 17.5 m -125.04 150.6 46.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.296 -0.878 . . . . 0.0 110.215 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.458 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 23.9 m-85 -112.76 160.87 29.07 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.273 -0.892 . . . . 0.0 110.29 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.417 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.49 -15.46 41.34 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.66 1.347 . . . . 0.0 110.608 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.458 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 50.0 p30 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.268 -0.895 . . . . 0.0 110.219 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -117.75 146.79 43.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -1.147 . . . . 0.0 110.202 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -130.86 160.17 35.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 110.172 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.444 ' OG1' ' N ' ' A' ' 6' ' ' SER . 34.6 p -87.27 -179.49 6.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.293 -0.879 . . . . 0.0 110.344 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 35.7 tttm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.172 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.504 ' CB ' HG12 ' A' ' 10' ' ' ILE . 1.8 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.264 0.554 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.462 HG21 ' O ' ' A' ' 6' ' ' SER . 7.0 pt -143.94 101.54 4.93 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.276 -0.89 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -63.4 148.96 66.13 Favored 'Cis proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.127 -2.03 . . . . 0.0 110.536 -0.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HA ' ' C ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -62.88 152.68 77.67 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.688 1.362 . . . . 0.0 110.56 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.504 HG12 ' CB ' ' A' ' 6' ' ' SER . 29.2 mm -109.46 136.36 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.08 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.8 m -121.96 148.68 44.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.882 . . . . 0.0 110.218 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.43 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 28.6 m-85 -109.54 165.04 13.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.56 -12.84 26.38 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.724 1.381 . . . . 0.0 110.579 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.6 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.256 -0.903 . . . . 0.0 110.162 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -126.88 141.53 51.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.325 -1.103 . . . . 0.0 110.204 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 95.1 m -118.92 162.45 18.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.201 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.461 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 37.2 p -96.61 165.93 11.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.7 tttt . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.196 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.533 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.225 0.535 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.593 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.4 tt -156.75 93.5 2.36 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.219 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.51 156.2 57.45 Favored 'Cis proline' 0 C--N 1.311 -1.415 0 C-N-CA 121.855 -2.144 . . . . 0.0 110.589 0.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.43 154.33 59.81 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.7 1.368 . . . . 0.0 110.51 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 9' ' ' PRO . 23.4 mm -114.71 139.34 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 49.9 m -103.47 155.38 18.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.278 -0.889 . . . . 0.0 110.184 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -121.0 159.02 50.94 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.37 -12.95 26.16 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.731 1.385 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.27 -0.894 . . . . 0.0 110.19 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.6 mtt-85 -125.7 141.67 51.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -1.114 . . . . 0.0 110.22 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 84.8 m -125.89 160.59 29.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.217 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -93.23 161.52 14.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 110.199 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.222 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.249 0.547 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.669 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.5 OUTLIER -172.45 93.23 0.39 Allowed Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.269 -0.894 . . . . 0.0 110.153 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.41 151.04 57.08 Favored 'Cis proline' 0 C--N 1.31 -1.462 0 C-N-CA 121.903 -2.124 . . . . 0.0 110.503 -0.064 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.57 140.02 84.63 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.724 1.381 . . . . 0.0 110.51 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.9 mt -96.92 136.46 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -0.953 . . . . 0.0 110.202 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.0 153.64 35.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.261 -0.9 . . . . 0.0 110.231 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.8 m-85 -115.84 161.97 27.89 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.897 . . . . 0.0 110.134 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.51 -11.94 22.24 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.709 1.373 . . . . 0.0 110.498 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.4 p30 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.0 110.226 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 11' ' ' CYS . 8.9 tpt180 -99.53 134.06 42.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 46.1 m -126.45 157.98 37.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.208 -0.933 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.43 ' C ' ' HG3' ' A' ' 5' ' ' LYS . 44.1 p -113.75 166.18 11.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.935 . . . . 0.0 110.261 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.43 ' HG3' ' C ' ' A' ' 4' ' ' THR . 54.3 mttm . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.177 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.524 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.261 0.553 . . . . 0.0 110.243 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.491 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -147.1 93.97 4.65 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.201 -0.937 . . . . 0.0 110.199 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.8 161.79 46.97 Favored 'Cis proline' 0 C--N 1.311 -1.433 0 C-N-CA 121.845 -2.148 . . . . 0.0 110.539 -0.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.524 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 157.69 40.52 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.664 1.35 . . . . 0.0 110.533 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -111.85 136.37 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 72.6 m -126.24 150.47 48.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 110.206 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -109.17 164.72 14.08 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 110.195 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.43 -16.57 48.26 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.705 1.371 . . . . 0.0 110.59 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.6 p30 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 110.238 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -121.86 147.51 45.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.259 -1.142 . . . . 0.0 110.16 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 88.2 m -128.19 160.82 30.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.231 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -86.65 164.79 16.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.289 -0.882 . . . . 0.0 110.224 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.2 tttt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.182 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.284 0.564 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.452 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.8 OUTLIER -173.24 94.42 0.35 Allowed Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.198 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.8 153.78 61.09 Favored 'Cis proline' 0 C--N 1.311 -1.429 0 C-N-CA 121.883 -2.132 . . . . 0.0 110.542 0.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -61.18 158.58 34.24 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.747 1.393 . . . . 0.0 110.559 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 9' ' ' PRO . 27.0 mm -114.04 142.35 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.228 -0.92 . . . . 0.0 110.179 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.3 m -121.97 147.94 45.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.268 -0.895 . . . . 0.0 110.226 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 24.4 m-85 -108.89 161.7 22.71 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 0.0 110.229 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -13.7 30.82 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.621 1.327 . . . . 0.0 110.499 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 48.1 p30 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 110.196 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 65.3 ttt180 -119.14 140.1 50.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -1.126 . . . . 0.0 110.24 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.7 m -127.1 165.23 19.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.214 -0.929 . . . . 0.0 110.274 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.5 p -107.04 166.94 10.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.341 -0.849 . . . . 0.0 110.211 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.25 -179.95 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 88.9 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.2 pp -139.14 95.49 9.37 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.193 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.49 165.77 38.21 Favored 'Cis proline' 0 C--N 1.313 -1.337 0 C-N-CA 121.884 -2.132 . . . . 0.0 110.509 -0.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.06 146.53 97.58 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.725 1.381 . . . . 0.0 110.516 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.6 mm -110.51 145.61 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.251 -0.906 . . . . 0.0 110.212 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -120.36 155.92 32.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.164 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.469 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.0 m-85 -115.1 161.59 28.63 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.257 -0.902 . . . . 0.0 110.253 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.23 -12.73 24.71 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.683 1.359 . . . . 0.0 110.593 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.469 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.8 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.137 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 49.9 ttp85 -116.13 140.5 49.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -1.153 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 70.1 m -126.0 155.46 41.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 110.229 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.0 p -95.88 169.0 10.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.32 -0.863 . . . . 0.0 110.197 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.161 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.184 0.516 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' PRO . 18.4 mm -149.54 95.17 3.79 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.23 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.2 164.99 39.04 Favored 'Cis proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.908 -2.122 . . . . 0.0 110.517 0.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.485 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.1 Cg_exo -60.39 150.93 78.01 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.743 1.391 . . . . 0.0 110.551 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.6 mt -113.28 143.03 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.206 -0.934 . . . . 0.0 110.283 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 68.3 m -119.44 152.59 36.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.223 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 18.3 m-85 -108.03 159.69 29.62 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.36 -12.2 22.84 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.652 1.343 . . . . 0.0 110.521 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.9 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.254 -0.903 . . . . 0.0 110.234 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.446 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 24.4 mmt85 -115.84 141.91 47.47 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.23 -1.159 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.0 m -129.43 158.87 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.196 -0.94 . . . . 0.0 110.187 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 5' ' ' LYS . 67.8 p -70.89 159.54 34.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 110.235 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 4' ' ' THR . 24.6 mttm . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 30.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.204 0.526 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.506 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.7 mp -139.2 96.59 8.9 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.191 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.82 165.56 35.12 Favored 'Cis proline' 0 C--N 1.312 -1.345 0 C-N-CA 121.939 -2.109 . . . . 0.0 110.541 0.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.59 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.46 150.7 84.01 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.71 1.374 . . . . 0.0 110.505 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.0 mt -112.17 141.39 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.179 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 52.8 m -121.24 154.33 36.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.273 -0.892 . . . . 0.0 110.244 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.7 m-85 -115.02 161.53 28.78 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.92 . . . . 0.0 110.179 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.33 23.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.714 1.376 . . . . 0.0 110.58 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.341 -0.849 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -115.4 149.53 37.83 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.263 -1.139 . . . . 0.0 110.153 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 20.6 m -127.41 156.11 42.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 110.213 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -27.81 63.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.178 -0.951 . . . . 0.0 110.287 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE3' ' CG ' ' A' ' 9' ' ' PRO . 21.9 mttt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.264 0.554 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.4 mt -139.27 95.56 9.22 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.91 . . . . 0.0 110.275 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.43 166.06 36.97 Favored 'Cis proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.886 -2.131 . . . . 0.0 110.602 0.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' CG ' ' HE3' ' A' ' 5' ' ' LYS . 3.0 Cg_exo -60.7 156.49 42.46 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.666 1.351 . . . . 0.0 110.483 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.4 mt -115.39 140.05 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 99.0 m -122.35 158.64 29.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.0 110.233 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 16.8 m-85 -116.27 159.23 40.6 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.288 -0.883 . . . . 0.0 110.162 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.94 -13.38 26.93 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.699 1.368 . . . . 0.0 110.505 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.7 p30 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.224 -0.923 . . . . 0.0 110.193 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 73.5 mtt85 -124.97 136.86 54.13 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.242 -1.152 . . . . 0.0 110.222 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.5 m -125.41 158.85 33.3 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.174 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.479 ' CB ' ' OG ' ' A' ' 6' ' ' SER . 32.2 p -86.82 160.65 18.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.23 -0.919 . . . . 0.0 110.207 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.4 mttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.257 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.491 ' O ' HD13 ' A' ' 7' ' ' ILE . 7.4 m . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.256 0.55 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 35.7 mm -147.66 96.11 4.16 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.181 -0.949 . . . . 0.0 110.249 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.8 Cg_endo -62.47 166.93 34.46 Favored 'Cis proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.925 -2.115 . . . . 0.0 110.661 -0.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.8 153.52 62.19 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 O-C-N 123.734 1.387 . . . . 0.0 110.498 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.2 mt -117.98 134.13 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 13.6 m -103.88 162.47 13.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 110.133 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.0 m-85 -124.19 154.62 68.57 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.193 -0.942 . . . . 0.0 110.18 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.75 -15.37 37.21 Favored 'Trans proline' 0 C--N 1.311 -1.417 0 O-C-N 123.727 1.383 . . . . 0.0 110.546 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.6 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.275 -0.89 . . . . 0.0 110.139 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 36.7 ttt180 -112.23 138.09 49.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.203 -1.175 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -122.98 158.48 30.39 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.88 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.4 p -112.76 168.34 9.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.359 -0.838 . . . . 0.0 110.219 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.46 ' OXT' ' HB3' ' A' ' 6' ' ' SER . 24.4 mttm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.604 ' C ' HG23 ' A' ' 7' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.276 0.56 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.604 HG23 ' C ' ' A' ' 6' ' ' SER . 1.1 pp -156.51 97.51 2.17 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.424 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.89 158.38 56.54 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.979 -2.092 . . . . 0.0 110.606 -0.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.25 157.36 40.51 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.745 1.392 . . . . 0.0 110.603 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.3 mt -121.6 131.43 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.217 -0.927 . . . . 0.0 110.206 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.2 m -117.63 156.84 27.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.244 -0.91 . . . . 0.0 110.251 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.4 m-85 -111.99 161.97 23.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.205 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -12.66 25.29 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.671 1.353 . . . . 0.0 110.568 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 46.0 p30 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.88 . . . . 0.0 110.13 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.497 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 56.9 mtm-85 -127.9 133.37 49.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.232 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -110.42 151.68 27.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.929 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.488 ' O ' ' CG ' ' A' ' 5' ' ' LYS . 60.2 p -85.54 175.84 8.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.207 -0.933 . . . . 0.0 110.201 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' A' ' 4' ' ' THR . 32.7 mttt . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.212 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 74.4 p . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.215 0.531 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.449 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.3 tt -156.74 94.59 2.28 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.435 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.22 153.49 56.95 Favored 'Cis proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.935 -2.11 . . . . 0.0 110.594 -0.037 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.46 156.5 46.32 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.682 1.359 . . . . 0.0 110.572 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 85.7 mt -125.13 133.14 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.177 -0.952 . . . . 0.0 110.204 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 2' ' ' ARG . 6.6 t -117.39 162.52 17.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.337 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.7 m-85 -116.8 162.05 29.16 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.235 -0.915 . . . . 0.0 110.226 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.33 -15.47 40.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.716 1.377 . . . . 0.0 110.444 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 50.0 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.116 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 47.1 mtm180 -122.46 138.88 54.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.196 -1.179 . . . . 0.0 110.213 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -120.58 161.03 22.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.16 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -29.99 70.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.276 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.509 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 57.0 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.288 0.566 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.543 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.4 tp -146.84 96.34 4.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.257 -0.902 . . . . 0.0 110.217 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.3 164.47 35.55 Favored 'Cis proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.889 -2.13 . . . . 0.0 110.671 0.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -60.92 160.27 26.17 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.64 1.337 . . . . 0.0 110.565 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.9 mm -112.31 136.7 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 110.264 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.3 m -118.62 159.53 23.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 110.199 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -125.89 159.11 63.17 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.76 -11.72 22.04 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.654 1.344 . . . . 0.0 110.551 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' A' ' 2' ' ' ARG . 52.8 p30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.152 -0.968 . . . . 0.0 110.18 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.415 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 79.1 mtt85 -117.11 109.93 17.55 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -1.138 . . . . 0.0 110.177 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 56.1 m -101.83 147.74 26.14 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.935 . . . . 0.0 110.319 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.4 p -87.52 -178.11 6.05 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.356 -0.84 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.4 mttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.241 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.282 0.563 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.9 tt -173.13 93.87 0.36 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.908 . . . . 0.0 110.16 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -60.02 158.32 43.96 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.843 -2.149 . . . . 0.0 110.615 0.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.68 150.1 87.11 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.733 1.386 . . . . 0.0 110.617 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.445 ' HA ' HD13 ' A' ' 10' ' ' ILE . 22.2 mm -111.43 134.05 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.319 -0.863 . . . . 0.0 110.135 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 2' ' ' ARG . 8.6 t -137.25 151.44 48.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.261 -0.9 . . . . 0.0 110.292 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -104.47 165.37 13.44 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 0.0 110.196 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.74 -11.85 22.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.741 1.39 . . . . 0.0 110.48 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.465 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 34.4 p-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.202 -0.936 . . . . 0.0 110.251 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 77.5 mtt85 -115.44 148.48 39.35 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.26 -1.141 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.2 m -135.17 156.81 48.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.265 -0.897 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -68.58 -32.98 73.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.254 -0.904 . . . . 0.0 110.221 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 tttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.224 179.951 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.202 0.525 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -171.55 92.82 0.42 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 110.144 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -60.09 157.06 46.62 Favored 'Cis proline' 0 C--N 1.31 -1.457 0 C-N-CA 121.834 -2.152 . . . . 0.0 110.573 0.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.19 151.08 81.35 Favored 'Trans proline' 0 C--N 1.312 -1.35 0 O-C-N 123.688 1.362 . . . . 0.0 110.733 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.6 tt -126.12 159.41 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.0 110.129 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 55.3 m -122.74 138.86 54.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.194 -0.942 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 41.2 m-85 -94.87 163.77 21.31 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.917 . . . . 0.0 110.25 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.437 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.56 -16.12 45.9 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.755 1.397 . . . . 0.0 110.554 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.4 p30 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.288 -0.883 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -118.37 142.72 47.25 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -1.127 . . . . 0.0 110.118 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -125.53 153.05 44.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.293 -0.879 . . . . 0.0 110.173 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.995 ' HG1' ' N ' ' A' ' 6' ' ' SER . 69.8 p -71.58 166.81 21.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.269 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.6 tttt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.995 ' N ' ' HG1' ' A' ' 4' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.221 0.534 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.763 HG23 ' O ' ' A' ' 7' ' ' ILE . 7.0 tp -157.61 100.46 1.86 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.285 -0.885 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.95 156.03 60.87 Favored 'Cis proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.688 0.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HA ' ' N ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.78 164.41 16.29 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.794 1.418 . . . . 0.0 110.551 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.3 mt -122.83 137.67 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.316 -0.865 . . . . 0.0 110.191 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.4 m -115.47 155.01 28.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 44.9 m-85 -118.55 164.3 21.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.222 -0.924 . . . . 0.0 110.143 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.38 24.01 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.641 1.338 . . . . 0.0 110.556 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.8 p30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.916 . . . . 0.0 110.223 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.0 ttt180 -127.56 135.98 51.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -1.092 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.3 m -123.31 151.43 42.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.426 ' HB ' ' OG ' ' A' ' 6' ' ' SER . 65.6 p -54.81 -44.69 74.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.261 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.225 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.568 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.205 0.526 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.7 tp -149.38 95.54 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.274 -0.891 . . . . 0.0 110.204 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.72 164.07 39.3 Favored 'Cis proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.882 -2.133 . . . . 0.0 110.611 0.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.33 149.6 88.68 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.773 1.407 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.6 mt -118.06 136.1 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.23 -0.919 . . . . 0.0 110.24 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 m -110.81 159.02 18.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.193 -0.942 . . . . 0.0 110.132 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.422 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 41.1 m-85 -125.45 159.96 57.81 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.305 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 -13.04 26.86 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.662 1.348 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -133.32 134.64 44.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.263 -1.139 . . . . 0.0 110.309 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 1.8 m -103.78 148.6 25.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.283 -0.885 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 5' ' ' LYS . 33.7 p -83.41 169.13 15.9 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.185 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 4' ' ' THR . 98.4 mttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.167 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.342 0.591 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.624 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.1 tp -162.49 93.55 1.25 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.168 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.97 162.65 45.34 Favored 'Cis proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.851 -2.145 . . . . 0.0 110.6 -0.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.82 151.6 69.82 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.605 1.318 . . . . 0.0 110.551 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 11' ' ' CYS . 9.5 tp -118.38 162.56 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' N ' HG13 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -116.22 137.64 51.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 110.247 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.471 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.1 m-85 -83.87 161.81 54.47 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.235 -0.916 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -60.8 -12.46 21.98 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 123.68 1.358 . . . . 0.0 110.563 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.2 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 110.258 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.416 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 25.6 ttt85 -88.16 95.91 10.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -1.171 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' CB ' ' A' ' 11' ' ' CYS . 40.2 m -103.72 148.2 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -0.902 . . . . 0.0 110.179 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.5 p -113.0 170.65 8.05 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.178 -0.951 . . . . 0.0 110.261 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 tttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.247 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.487 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 58.8 m . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.389 0.614 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -141.19 95.62 7.39 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.196 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -62.08 162.6 46.19 Favored 'Cis proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.923 -2.116 . . . . 0.0 110.548 -0.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.487 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 150.86 83.58 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.646 1.34 . . . . 0.0 110.555 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.5 mt -123.85 139.44 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.944 . . . . 0.0 110.206 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.462 ' CB ' ' HA ' ' A' ' 3' ' ' CYS . 51.4 t -131.31 157.49 43.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 110.234 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -104.22 164.55 15.06 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.211 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -17.54 54.04 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.635 1.334 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.906 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.445 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 94.2 mtt-85 -118.74 144.39 46.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.174 -1.192 . . . . 0.0 110.12 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.2 m -132.15 153.86 50.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.472 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 57.9 p -51.1 -44.37 61.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.208 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 52.7 tttm . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.207 179.986 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 1.4 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.285 0.564 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 6' ' ' SER . 29.6 mt -154.19 96.75 2.66 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.341 -0.849 . . . . 0.0 110.22 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.7 150.87 65.72 Favored 'Cis proline' 0 C--N 1.312 -1.358 0 C-N-CA 121.953 -2.103 . . . . 0.0 110.584 -0.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -62.15 154.02 65.56 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.613 1.323 . . . . 0.0 110.509 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.431 ' HB ' HG23 ' A' ' 4' ' ' THR . 51.6 mt -118.58 143.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -0.898 . . . . 0.0 110.175 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 17.5 m -125.04 150.6 46.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.296 -0.878 . . . . 0.0 110.215 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.474 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 23.9 m-85 -112.76 160.87 29.07 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.273 -0.892 . . . . 0.0 110.29 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.49 -15.46 41.34 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.66 1.347 . . . . 0.0 110.608 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 50.0 p30 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.268 -0.895 . . . . 0.0 110.219 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -117.75 146.79 43.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -1.147 . . . . 0.0 110.202 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 94.4 m -130.86 160.17 35.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 110.172 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.943 ' HG1' ' N ' ' A' ' 6' ' ' SER . 34.6 p -87.27 -179.49 6.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.293 -0.879 . . . . 0.0 110.344 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 35.7 tttm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.172 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.943 ' N ' ' HG1' ' A' ' 4' ' ' THR . 1.8 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.264 0.554 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 7' ' ' ILE . 7.0 pt -143.94 101.54 4.93 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.276 -0.89 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -63.4 148.96 66.13 Favored 'Cis proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.127 -2.03 . . . . 0.0 110.536 -0.031 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_endo -62.88 152.68 77.67 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.688 1.362 . . . . 0.0 110.56 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' CB ' ' A' ' 6' ' ' SER . 29.2 mm -109.46 136.36 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.08 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 94.8 m -121.96 148.68 44.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.882 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.423 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 28.6 m-85 -109.54 165.04 13.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.56 -12.84 26.38 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.724 1.381 . . . . 0.0 110.579 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.6 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.256 -0.903 . . . . 0.0 110.162 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -126.88 141.53 51.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.325 -1.103 . . . . 0.0 110.204 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 95.1 m -118.92 162.45 18.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.201 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.461 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 37.2 p -96.61 165.93 11.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.7 tttt . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.196 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.533 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.225 0.535 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.593 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.4 tt -156.75 93.5 2.36 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.219 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.51 156.2 57.45 Favored 'Cis proline' 0 C--N 1.311 -1.415 0 C-N-CA 121.855 -2.144 . . . . 0.0 110.589 0.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.43 154.33 59.81 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.7 1.368 . . . . 0.0 110.51 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 9' ' ' PRO . 23.4 mm -114.71 139.34 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 49.9 m -103.47 155.38 18.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.278 -0.889 . . . . 0.0 110.184 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -121.0 159.02 50.94 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.37 -12.95 26.16 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.731 1.385 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.27 -0.894 . . . . 0.0 110.19 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.6 mtt-85 -125.7 141.67 51.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -1.114 . . . . 0.0 110.22 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 84.8 m -125.89 160.59 29.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.217 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -93.23 161.52 14.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 110.199 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.222 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.249 0.547 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.669 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.5 OUTLIER -172.45 93.23 0.39 Allowed Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.269 -0.894 . . . . 0.0 110.153 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.41 151.04 57.08 Favored 'Cis proline' 0 C--N 1.31 -1.462 0 C-N-CA 121.903 -2.124 . . . . 0.0 110.503 -0.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.57 140.02 84.63 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.724 1.381 . . . . 0.0 110.51 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.9 mt -96.92 136.46 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -0.953 . . . . 0.0 110.202 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.0 153.64 35.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.261 -0.9 . . . . 0.0 110.231 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.8 m-85 -115.84 161.97 27.89 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.897 . . . . 0.0 110.134 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.51 -11.94 22.24 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.709 1.373 . . . . 0.0 110.498 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.4 p30 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.0 110.226 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 11' ' ' CYS . 8.9 tpt180 -99.53 134.06 42.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 46.1 m -126.45 157.98 37.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.208 -0.933 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.43 ' C ' ' HG3' ' A' ' 5' ' ' LYS . 44.1 p -113.75 166.18 11.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.935 . . . . 0.0 110.261 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.43 ' HG3' ' C ' ' A' ' 4' ' ' THR . 54.3 mttm . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.177 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.524 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.261 0.553 . . . . 0.0 110.243 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.491 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -147.1 93.97 4.65 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.201 -0.937 . . . . 0.0 110.199 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.8 161.79 46.97 Favored 'Cis proline' 0 C--N 1.311 -1.433 0 C-N-CA 121.845 -2.148 . . . . 0.0 110.539 -0.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.524 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 157.69 40.52 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.664 1.35 . . . . 0.0 110.533 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -111.85 136.37 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 72.6 m -126.24 150.47 48.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 110.206 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -109.17 164.72 14.08 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 110.195 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.43 -16.57 48.26 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.705 1.371 . . . . 0.0 110.59 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.6 p30 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 110.238 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -121.86 147.51 45.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.259 -1.142 . . . . 0.0 110.16 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 88.2 m -128.19 160.82 30.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.231 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -86.65 164.79 16.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.289 -0.882 . . . . 0.0 110.224 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.2 tttt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.182 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.284 0.564 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.452 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.8 OUTLIER -173.24 94.42 0.35 Allowed Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.198 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.8 153.78 61.09 Favored 'Cis proline' 0 C--N 1.311 -1.429 0 C-N-CA 121.883 -2.132 . . . . 0.0 110.542 0.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -61.18 158.58 34.24 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.747 1.393 . . . . 0.0 110.559 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 9' ' ' PRO . 27.0 mm -114.04 142.35 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.228 -0.92 . . . . 0.0 110.179 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.3 m -121.97 147.94 45.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.268 -0.895 . . . . 0.0 110.226 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 24.4 m-85 -108.89 161.7 22.71 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 0.0 110.229 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -13.7 30.82 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.621 1.327 . . . . 0.0 110.499 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 48.1 p30 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 110.196 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 65.3 ttt180 -119.14 140.1 50.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -1.126 . . . . 0.0 110.24 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.7 m -127.1 165.23 19.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.214 -0.929 . . . . 0.0 110.274 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.5 p -107.04 166.94 10.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.341 -0.849 . . . . 0.0 110.211 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.25 -179.95 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 88.9 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.2 pp -139.14 95.49 9.37 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.193 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.49 165.77 38.21 Favored 'Cis proline' 0 C--N 1.313 -1.337 0 C-N-CA 121.884 -2.132 . . . . 0.0 110.509 -0.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.06 146.53 97.58 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.725 1.381 . . . . 0.0 110.516 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.6 mm -110.51 145.61 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.251 -0.906 . . . . 0.0 110.212 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -120.36 155.92 32.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.164 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.469 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.0 m-85 -115.1 161.59 28.63 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.257 -0.902 . . . . 0.0 110.253 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.23 -12.73 24.71 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.683 1.359 . . . . 0.0 110.593 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.469 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.8 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.137 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 49.9 ttp85 -116.13 140.5 49.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -1.153 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 70.1 m -126.0 155.46 41.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 110.229 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.0 p -95.88 169.0 10.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.32 -0.863 . . . . 0.0 110.197 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.161 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.184 0.516 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' PRO . 18.4 mm -149.54 95.17 3.79 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.23 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.2 164.99 39.04 Favored 'Cis proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.908 -2.122 . . . . 0.0 110.517 0.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.485 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.1 Cg_exo -60.39 150.93 78.01 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.743 1.391 . . . . 0.0 110.551 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.6 mt -113.28 143.03 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.206 -0.934 . . . . 0.0 110.283 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 68.3 m -119.44 152.59 36.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.223 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 18.3 m-85 -108.03 159.69 29.62 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.36 -12.2 22.84 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.652 1.343 . . . . 0.0 110.521 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.9 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.254 -0.903 . . . . 0.0 110.234 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.446 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 24.4 mmt85 -115.84 141.91 47.47 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.23 -1.159 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.0 m -129.43 158.87 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.196 -0.94 . . . . 0.0 110.187 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 5' ' ' LYS . 67.8 p -70.89 159.54 34.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 110.235 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 4' ' ' THR . 24.6 mttm . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 30.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.204 0.526 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.506 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.7 mp -139.2 96.59 8.9 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.191 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.82 165.56 35.12 Favored 'Cis proline' 0 C--N 1.312 -1.345 0 C-N-CA 121.939 -2.109 . . . . 0.0 110.541 0.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.59 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.46 150.7 84.01 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.71 1.374 . . . . 0.0 110.505 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.0 mt -112.17 141.39 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.179 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 52.8 m -121.24 154.33 36.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.273 -0.892 . . . . 0.0 110.244 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.7 m-85 -115.02 161.53 28.78 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.92 . . . . 0.0 110.179 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.33 23.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.714 1.376 . . . . 0.0 110.58 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.341 -0.849 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -115.4 149.53 37.83 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.263 -1.139 . . . . 0.0 110.153 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 20.6 m -127.41 156.11 42.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 110.213 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -27.81 63.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.178 -0.951 . . . . 0.0 110.287 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE3' ' CG ' ' A' ' 9' ' ' PRO . 21.9 mttt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.264 0.554 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.4 mt -139.27 95.56 9.22 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.91 . . . . 0.0 110.275 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.43 166.06 36.97 Favored 'Cis proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.886 -2.131 . . . . 0.0 110.602 0.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' CG ' ' HE3' ' A' ' 5' ' ' LYS . 3.0 Cg_exo -60.7 156.49 42.46 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.666 1.351 . . . . 0.0 110.483 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.4 mt -115.39 140.05 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 99.0 m -122.35 158.64 29.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.0 110.233 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 16.8 m-85 -116.27 159.23 40.6 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.288 -0.883 . . . . 0.0 110.162 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.94 -13.38 26.93 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.699 1.368 . . . . 0.0 110.505 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.7 p30 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.224 -0.923 . . . . 0.0 110.193 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 73.5 mtt85 -124.97 136.86 54.13 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.242 -1.152 . . . . 0.0 110.222 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.5 m -125.41 158.85 33.3 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.174 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.479 ' CB ' ' OG ' ' A' ' 6' ' ' SER . 32.2 p -86.82 160.65 18.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.23 -0.919 . . . . 0.0 110.207 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.4 mttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.257 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.491 ' O ' HD13 ' A' ' 7' ' ' ILE . 7.4 m . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.256 0.55 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 35.7 mm -147.66 96.11 4.16 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.181 -0.949 . . . . 0.0 110.249 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.8 Cg_endo -62.47 166.93 34.46 Favored 'Cis proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.925 -2.115 . . . . 0.0 110.661 -0.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.8 153.52 62.19 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 O-C-N 123.734 1.387 . . . . 0.0 110.498 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.2 mt -117.98 134.13 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 13.6 m -103.88 162.47 13.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 110.133 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.0 m-85 -124.19 154.62 68.57 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.193 -0.942 . . . . 0.0 110.18 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.75 -15.37 37.21 Favored 'Trans proline' 0 C--N 1.311 -1.417 0 O-C-N 123.727 1.383 . . . . 0.0 110.546 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.6 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.275 -0.89 . . . . 0.0 110.139 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 36.7 ttt180 -112.23 138.09 49.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.203 -1.175 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -122.98 158.48 30.39 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.88 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.4 p -112.76 168.34 9.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.359 -0.838 . . . . 0.0 110.219 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' OXT' ' HB3' ' A' ' 6' ' ' SER . 24.4 mttm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.604 ' C ' HG23 ' A' ' 7' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.276 0.56 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.604 HG23 ' C ' ' A' ' 6' ' ' SER . 1.1 pp -156.51 97.51 2.17 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.89 158.38 56.54 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.979 -2.092 . . . . 0.0 110.606 -0.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.25 157.36 40.51 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.745 1.392 . . . . 0.0 110.603 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.3 mt -121.6 131.43 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.217 -0.927 . . . . 0.0 110.206 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.2 m -117.63 156.84 27.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.244 -0.91 . . . . 0.0 110.251 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.4 m-85 -111.99 161.97 23.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.205 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -12.66 25.29 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.671 1.353 . . . . 0.0 110.568 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 46.0 p30 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.88 . . . . 0.0 110.13 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 56.9 mtm-85 -127.9 133.37 49.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.232 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -110.42 151.68 27.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.929 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.488 ' O ' ' CG ' ' A' ' 5' ' ' LYS . 60.2 p -85.54 175.84 8.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.207 -0.933 . . . . 0.0 110.201 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' A' ' 4' ' ' THR . 32.7 mttt . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.212 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 74.4 p . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.215 0.531 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.449 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.3 tt -156.74 94.59 2.28 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.435 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.22 153.49 56.95 Favored 'Cis proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.935 -2.11 . . . . 0.0 110.594 -0.037 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.46 156.5 46.32 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.682 1.359 . . . . 0.0 110.572 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 85.7 mt -125.13 133.14 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.177 -0.952 . . . . 0.0 110.204 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 2' ' ' ARG . 6.6 t -117.39 162.52 17.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.337 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.7 m-85 -116.8 162.05 29.16 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.235 -0.915 . . . . 0.0 110.226 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.33 -15.47 40.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.716 1.377 . . . . 0.0 110.444 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 50.0 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.116 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 47.1 mtm180 -122.46 138.88 54.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.196 -1.179 . . . . 0.0 110.213 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -120.58 161.03 22.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.16 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -29.99 70.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.276 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.509 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 57.0 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.288 0.566 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.543 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.4 tp -146.84 96.34 4.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.257 -0.902 . . . . 0.0 110.217 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.3 164.47 35.55 Favored 'Cis proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.889 -2.13 . . . . 0.0 110.671 0.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -60.92 160.27 26.17 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.64 1.337 . . . . 0.0 110.565 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.9 mm -112.31 136.7 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 110.264 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.3 m -118.62 159.53 23.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 110.199 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -125.89 159.11 63.17 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.76 -11.72 22.04 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.654 1.344 . . . . 0.0 110.551 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' A' ' 2' ' ' ARG . 52.8 p30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.152 -0.968 . . . . 0.0 110.18 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 79.1 mtt85 -117.11 109.93 17.55 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -1.138 . . . . 0.0 110.177 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 56.1 m -101.83 147.74 26.14 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.935 . . . . 0.0 110.319 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.4 p -87.52 -178.11 6.05 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.356 -0.84 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.4 mttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.241 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.282 0.563 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.9 tt -173.13 93.87 0.36 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.908 . . . . 0.0 110.16 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -60.02 158.32 43.96 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.843 -2.149 . . . . 0.0 110.615 0.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.68 150.1 87.11 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.733 1.386 . . . . 0.0 110.617 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.445 ' HA ' HD13 ' A' ' 10' ' ' ILE . 22.2 mm -111.43 134.05 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.319 -0.863 . . . . 0.0 110.135 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 2' ' ' ARG . 8.6 t -137.25 151.44 48.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.261 -0.9 . . . . 0.0 110.292 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -104.47 165.37 13.44 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 0.0 110.196 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.74 -11.85 22.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.741 1.39 . . . . 0.0 110.48 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.465 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 34.4 p-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.202 -0.936 . . . . 0.0 110.251 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 77.5 mtt85 -115.44 148.48 39.35 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.26 -1.141 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.2 m -135.17 156.81 48.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.265 -0.897 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -68.58 -32.98 73.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.254 -0.904 . . . . 0.0 110.221 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 tttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.224 179.951 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.202 0.525 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -171.55 92.82 0.42 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 110.144 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -60.09 157.06 46.62 Favored 'Cis proline' 0 C--N 1.31 -1.457 0 C-N-CA 121.834 -2.152 . . . . 0.0 110.573 0.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.19 151.08 81.35 Favored 'Trans proline' 0 C--N 1.312 -1.35 0 O-C-N 123.688 1.362 . . . . 0.0 110.733 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.6 tt -126.12 159.41 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.0 110.129 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 55.3 m -122.74 138.86 54.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.194 -0.942 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 41.2 m-85 -94.87 163.77 21.31 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.917 . . . . 0.0 110.25 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.437 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.56 -16.12 45.9 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.755 1.397 . . . . 0.0 110.554 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.4 p30 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.288 -0.883 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -118.37 142.72 47.25 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -1.127 . . . . 0.0 110.118 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -125.53 153.05 44.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.293 -0.879 . . . . 0.0 110.173 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.995 ' HG1' ' N ' ' A' ' 6' ' ' SER . 69.8 p -71.58 166.81 21.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.269 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.6 tttt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.995 ' N ' ' HG1' ' A' ' 4' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.221 0.534 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.763 HG23 ' O ' ' A' ' 7' ' ' ILE . 7.0 tp -157.61 100.46 1.86 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.285 -0.885 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.95 156.03 60.87 Favored 'Cis proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.688 0.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HA ' ' N ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.78 164.41 16.29 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.794 1.418 . . . . 0.0 110.551 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.3 mt -122.83 137.67 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.316 -0.865 . . . . 0.0 110.191 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.4 m -115.47 155.01 28.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 44.9 m-85 -118.55 164.3 21.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.222 -0.924 . . . . 0.0 110.143 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.38 24.01 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.641 1.338 . . . . 0.0 110.556 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.8 p30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.916 . . . . 0.0 110.223 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.0 ttt180 -127.56 135.98 51.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -1.092 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.3 m -123.31 151.43 42.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.426 ' HB ' ' OG ' ' A' ' 6' ' ' SER . 65.6 p -54.81 -44.69 74.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.261 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.225 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.568 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.205 0.526 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.7 tp -149.38 95.54 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.274 -0.891 . . . . 0.0 110.204 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.72 164.07 39.3 Favored 'Cis proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.882 -2.133 . . . . 0.0 110.611 0.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.33 149.6 88.68 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.773 1.407 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.6 mt -118.06 136.1 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.23 -0.919 . . . . 0.0 110.24 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 m -110.81 159.02 18.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.193 -0.942 . . . . 0.0 110.132 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.422 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 41.1 m-85 -125.45 159.96 57.81 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.305 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 -13.04 26.86 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.662 1.348 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -133.32 134.64 44.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.263 -1.139 . . . . 0.0 110.309 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 1.8 m -103.78 148.6 25.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.283 -0.885 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 5' ' ' LYS . 33.7 p -83.41 169.13 15.9 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.185 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 4' ' ' THR . 98.4 mttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.167 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.342 0.591 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.624 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.1 tp -162.49 93.55 1.25 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.168 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.97 162.65 45.34 Favored 'Cis proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.851 -2.145 . . . . 0.0 110.6 -0.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.82 151.6 69.82 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.605 1.318 . . . . 0.0 110.551 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 11' ' ' CYS . 9.5 tp -118.38 162.56 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' N ' HG13 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -116.22 137.64 51.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 110.247 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.471 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.1 m-85 -83.87 161.81 54.47 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.235 -0.916 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -60.8 -12.46 21.98 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 123.68 1.358 . . . . 0.0 110.563 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.2 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 110.258 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.416 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 25.6 ttt85 -88.16 95.91 10.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -1.171 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' CB ' ' A' ' 11' ' ' CYS . 40.2 m -103.72 148.2 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -0.902 . . . . 0.0 110.179 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.5 p -113.0 170.65 8.05 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.178 -0.951 . . . . 0.0 110.261 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 tttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.247 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.487 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 58.8 m . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.389 0.614 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -141.19 95.62 7.39 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.196 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -62.08 162.6 46.19 Favored 'Cis proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.923 -2.116 . . . . 0.0 110.548 -0.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.487 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 150.86 83.58 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.646 1.34 . . . . 0.0 110.555 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.5 mt -123.85 139.44 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.944 . . . . 0.0 110.206 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.462 ' CB ' ' HA ' ' A' ' 3' ' ' CYS . 51.4 t -131.31 157.49 43.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 110.234 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -104.22 164.55 15.06 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.211 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -17.54 54.04 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.635 1.334 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.906 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.445 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 94.2 mtt-85 -118.74 144.39 46.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.174 -1.192 . . . . 0.0 110.12 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.2 m -132.15 153.86 50.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.472 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 57.9 p -51.1 -44.37 61.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.208 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 52.7 tttm . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.207 179.986 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 1.4 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.285 0.564 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 6' ' ' SER . 29.6 mt -154.19 96.75 2.66 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.341 -0.849 . . . . 0.0 110.22 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.7 150.87 65.72 Favored 'Cis proline' 0 C--N 1.312 -1.358 0 C-N-CA 121.953 -2.103 . . . . 0.0 110.584 -0.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -62.15 154.02 65.56 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.613 1.323 . . . . 0.0 110.509 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.431 ' HB ' HG23 ' A' ' 4' ' ' THR . 51.6 mt -118.58 143.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -0.898 . . . . 0.0 110.175 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 17.5 m -125.04 150.6 46.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.296 -0.878 . . . . 0.0 110.215 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.474 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 23.9 m-85 -112.76 160.87 29.07 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.273 -0.892 . . . . 0.0 110.29 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.49 -15.46 41.34 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.66 1.347 . . . . 0.0 110.608 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 50.0 p30 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.268 -0.895 . . . . 0.0 110.219 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -117.75 146.79 43.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -1.147 . . . . 0.0 110.202 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 94.4 m -130.86 160.17 35.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 110.172 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.943 ' HG1' ' N ' ' A' ' 6' ' ' SER . 34.6 p -87.27 -179.49 6.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.293 -0.879 . . . . 0.0 110.344 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 35.7 tttm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.172 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.943 ' N ' ' HG1' ' A' ' 4' ' ' THR . 1.8 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.264 0.554 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 7' ' ' ILE . 7.0 pt -143.94 101.54 4.93 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.276 -0.89 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -63.4 148.96 66.13 Favored 'Cis proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.127 -2.03 . . . . 0.0 110.536 -0.031 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_endo -62.88 152.68 77.67 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.688 1.362 . . . . 0.0 110.56 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' CB ' ' A' ' 6' ' ' SER . 29.2 mm -109.46 136.36 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.08 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 94.8 m -121.96 148.68 44.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.882 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.423 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 28.6 m-85 -109.54 165.04 13.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.56 -12.84 26.38 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.724 1.381 . . . . 0.0 110.579 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.6 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.256 -0.903 . . . . 0.0 110.162 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -126.88 141.53 51.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.325 -1.103 . . . . 0.0 110.204 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 95.1 m -118.92 162.45 18.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.201 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.461 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 37.2 p -96.61 165.93 11.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.7 tttt . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.196 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.533 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.225 0.535 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.593 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.4 tt -156.75 93.5 2.36 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.219 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.51 156.2 57.45 Favored 'Cis proline' 0 C--N 1.311 -1.415 0 C-N-CA 121.855 -2.144 . . . . 0.0 110.589 0.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.43 154.33 59.81 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.7 1.368 . . . . 0.0 110.51 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 9' ' ' PRO . 23.4 mm -114.71 139.34 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 49.9 m -103.47 155.38 18.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.278 -0.889 . . . . 0.0 110.184 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -121.0 159.02 50.94 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.37 -12.95 26.16 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.731 1.385 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.27 -0.894 . . . . 0.0 110.19 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.6 mtt-85 -125.7 141.67 51.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -1.114 . . . . 0.0 110.22 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 84.8 m -125.89 160.59 29.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.217 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -93.23 161.52 14.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 110.199 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.222 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.249 0.547 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.669 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.5 OUTLIER -172.45 93.23 0.39 Allowed Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.269 -0.894 . . . . 0.0 110.153 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.438 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.41 151.04 57.08 Favored 'Cis proline' 0 C--N 1.31 -1.462 0 C-N-CA 121.903 -2.124 . . . . 0.0 110.503 -0.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.57 140.02 84.63 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.724 1.381 . . . . 0.0 110.51 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.9 mt -96.92 136.46 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -0.953 . . . . 0.0 110.202 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.0 153.64 35.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.261 -0.9 . . . . 0.0 110.231 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.8 m-85 -115.84 161.97 27.89 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.897 . . . . 0.0 110.134 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.51 -11.94 22.24 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.709 1.373 . . . . 0.0 110.498 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.4 p30 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.0 110.226 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 11' ' ' CYS . 8.9 tpt180 -99.53 134.06 42.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 46.1 m -126.45 157.98 37.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.208 -0.933 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.43 ' C ' ' HG3' ' A' ' 5' ' ' LYS . 44.1 p -113.75 166.18 11.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.935 . . . . 0.0 110.261 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.43 ' HG3' ' C ' ' A' ' 4' ' ' THR . 54.3 mttm . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.177 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.524 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.261 0.553 . . . . 0.0 110.243 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.491 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -147.1 93.97 4.65 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.201 -0.937 . . . . 0.0 110.199 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.8 161.79 46.97 Favored 'Cis proline' 0 C--N 1.311 -1.433 0 C-N-CA 121.845 -2.148 . . . . 0.0 110.539 -0.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.524 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 157.69 40.52 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.664 1.35 . . . . 0.0 110.533 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -111.85 136.37 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 72.6 m -126.24 150.47 48.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 110.206 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -109.17 164.72 14.08 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 110.195 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.43 -16.57 48.26 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.705 1.371 . . . . 0.0 110.59 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.6 p30 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 110.238 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -121.86 147.51 45.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.259 -1.142 . . . . 0.0 110.16 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 88.2 m -128.19 160.82 30.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.231 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -86.65 164.79 16.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.289 -0.882 . . . . 0.0 110.224 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.2 tttt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.182 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.284 0.564 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.452 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.8 OUTLIER -173.24 94.42 0.35 Allowed Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.198 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.8 153.78 61.09 Favored 'Cis proline' 0 C--N 1.311 -1.429 0 C-N-CA 121.883 -2.132 . . . . 0.0 110.542 0.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -61.18 158.58 34.24 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.747 1.393 . . . . 0.0 110.559 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 9' ' ' PRO . 27.0 mm -114.04 142.35 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.228 -0.92 . . . . 0.0 110.179 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.3 m -121.97 147.94 45.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.268 -0.895 . . . . 0.0 110.226 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 24.4 m-85 -108.89 161.7 22.71 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 0.0 110.229 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -13.7 30.82 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.621 1.327 . . . . 0.0 110.499 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 48.1 p30 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 110.196 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 65.3 ttt180 -119.14 140.1 50.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -1.126 . . . . 0.0 110.24 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.7 m -127.1 165.23 19.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.214 -0.929 . . . . 0.0 110.274 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.5 p -107.04 166.94 10.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.341 -0.849 . . . . 0.0 110.211 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.25 -179.95 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 88.9 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.2 pp -139.14 95.49 9.37 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.193 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.49 165.77 38.21 Favored 'Cis proline' 0 C--N 1.313 -1.337 0 C-N-CA 121.884 -2.132 . . . . 0.0 110.509 -0.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.06 146.53 97.58 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.725 1.381 . . . . 0.0 110.516 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.6 mm -110.51 145.61 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.251 -0.906 . . . . 0.0 110.212 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -120.36 155.92 32.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.164 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.469 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.0 m-85 -115.1 161.59 28.63 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.257 -0.902 . . . . 0.0 110.253 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.23 -12.73 24.71 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.683 1.359 . . . . 0.0 110.593 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.469 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.8 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.137 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 49.9 ttp85 -116.13 140.5 49.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -1.153 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 70.1 m -126.0 155.46 41.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 110.229 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.0 p -95.88 169.0 10.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.32 -0.863 . . . . 0.0 110.197 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.161 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.184 0.516 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' PRO . 18.4 mm -149.54 95.17 3.79 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.23 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.2 164.99 39.04 Favored 'Cis proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.908 -2.122 . . . . 0.0 110.517 0.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.485 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.1 Cg_exo -60.39 150.93 78.01 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.743 1.391 . . . . 0.0 110.551 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.6 mt -113.28 143.03 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.206 -0.934 . . . . 0.0 110.283 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 68.3 m -119.44 152.59 36.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.223 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 18.3 m-85 -108.03 159.69 29.62 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.36 -12.2 22.84 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.652 1.343 . . . . 0.0 110.521 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.9 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.254 -0.903 . . . . 0.0 110.234 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.446 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 24.4 mmt85 -115.84 141.91 47.47 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.23 -1.159 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.0 m -129.43 158.87 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.196 -0.94 . . . . 0.0 110.187 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 5' ' ' LYS . 67.8 p -70.89 159.54 34.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 110.235 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 4' ' ' THR . 24.6 mttm . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 30.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.204 0.526 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.506 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.7 mp -139.2 96.59 8.9 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.191 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.82 165.56 35.12 Favored 'Cis proline' 0 C--N 1.312 -1.345 0 C-N-CA 121.939 -2.109 . . . . 0.0 110.541 0.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.59 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.46 150.7 84.01 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.71 1.374 . . . . 0.0 110.505 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.0 mt -112.17 141.39 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.179 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 52.8 m -121.24 154.33 36.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.273 -0.892 . . . . 0.0 110.244 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.7 m-85 -115.02 161.53 28.78 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.92 . . . . 0.0 110.179 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.33 23.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.714 1.376 . . . . 0.0 110.58 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.341 -0.849 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -115.4 149.53 37.83 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.263 -1.139 . . . . 0.0 110.153 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 20.6 m -127.41 156.11 42.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 110.213 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -27.81 63.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.178 -0.951 . . . . 0.0 110.287 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE3' ' CG ' ' A' ' 9' ' ' PRO . 21.9 mttt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.264 0.554 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.4 mt -139.27 95.56 9.22 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.91 . . . . 0.0 110.275 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.43 166.06 36.97 Favored 'Cis proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.886 -2.131 . . . . 0.0 110.602 0.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' CG ' ' HE3' ' A' ' 5' ' ' LYS . 3.0 Cg_exo -60.7 156.49 42.46 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.666 1.351 . . . . 0.0 110.483 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.4 mt -115.39 140.05 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 99.0 m -122.35 158.64 29.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.0 110.233 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 16.8 m-85 -116.27 159.23 40.6 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.288 -0.883 . . . . 0.0 110.162 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.94 -13.38 26.93 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.699 1.368 . . . . 0.0 110.505 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.7 p30 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.224 -0.923 . . . . 0.0 110.193 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 73.5 mtt85 -124.97 136.86 54.13 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.242 -1.152 . . . . 0.0 110.222 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.5 m -125.41 158.85 33.3 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.174 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.479 ' CB ' ' OG ' ' A' ' 6' ' ' SER . 32.2 p -86.82 160.65 18.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.23 -0.919 . . . . 0.0 110.207 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.4 mttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.257 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.491 ' O ' HD13 ' A' ' 7' ' ' ILE . 7.4 m . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.256 0.55 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 35.7 mm -147.66 96.11 4.16 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.181 -0.949 . . . . 0.0 110.249 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.8 Cg_endo -62.47 166.93 34.46 Favored 'Cis proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.925 -2.115 . . . . 0.0 110.661 -0.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.8 153.52 62.19 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 O-C-N 123.734 1.387 . . . . 0.0 110.498 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.2 mt -117.98 134.13 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 13.6 m -103.88 162.47 13.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 110.133 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.0 m-85 -124.19 154.62 68.57 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.193 -0.942 . . . . 0.0 110.18 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.75 -15.37 37.21 Favored 'Trans proline' 0 C--N 1.311 -1.417 0 O-C-N 123.727 1.383 . . . . 0.0 110.546 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.6 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.275 -0.89 . . . . 0.0 110.139 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 36.7 ttt180 -112.23 138.09 49.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.203 -1.175 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -122.98 158.48 30.39 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.88 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.4 p -112.76 168.34 9.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.359 -0.838 . . . . 0.0 110.219 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.46 ' OXT' ' HB3' ' A' ' 6' ' ' SER . 24.4 mttm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.604 ' C ' HG23 ' A' ' 7' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.276 0.56 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.604 HG23 ' C ' ' A' ' 6' ' ' SER . 1.1 pp -156.51 97.51 2.17 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.424 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.89 158.38 56.54 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.979 -2.092 . . . . 0.0 110.606 -0.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.25 157.36 40.51 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.745 1.392 . . . . 0.0 110.603 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.3 mt -121.6 131.43 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.217 -0.927 . . . . 0.0 110.206 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.2 m -117.63 156.84 27.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.244 -0.91 . . . . 0.0 110.251 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.4 m-85 -111.99 161.97 23.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.205 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -12.66 25.29 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.671 1.353 . . . . 0.0 110.568 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 46.0 p30 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.88 . . . . 0.0 110.13 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.497 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 56.9 mtm-85 -127.9 133.37 49.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.232 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -110.42 151.68 27.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.929 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.488 ' O ' ' CG ' ' A' ' 5' ' ' LYS . 60.2 p -85.54 175.84 8.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.207 -0.933 . . . . 0.0 110.201 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' A' ' 4' ' ' THR . 32.7 mttt . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.212 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 74.4 p . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.215 0.531 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.449 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.3 tt -156.74 94.59 2.28 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.435 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.22 153.49 56.95 Favored 'Cis proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.935 -2.11 . . . . 0.0 110.594 -0.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.46 156.5 46.32 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.682 1.359 . . . . 0.0 110.572 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 85.7 mt -125.13 133.14 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.177 -0.952 . . . . 0.0 110.204 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 2' ' ' ARG . 6.6 t -117.39 162.52 17.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.337 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.7 m-85 -116.8 162.05 29.16 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.235 -0.915 . . . . 0.0 110.226 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.33 -15.47 40.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.716 1.377 . . . . 0.0 110.444 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 50.0 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.116 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 47.1 mtm180 -122.46 138.88 54.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.196 -1.179 . . . . 0.0 110.213 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -120.58 161.03 22.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.16 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -29.99 70.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.276 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.509 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 57.0 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.288 0.566 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.543 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.4 tp -146.84 96.34 4.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.257 -0.902 . . . . 0.0 110.217 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.3 164.47 35.55 Favored 'Cis proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.889 -2.13 . . . . 0.0 110.671 0.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -60.92 160.27 26.17 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.64 1.337 . . . . 0.0 110.565 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.9 mm -112.31 136.7 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 110.264 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.3 m -118.62 159.53 23.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 110.199 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -125.89 159.11 63.17 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.76 -11.72 22.04 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.654 1.344 . . . . 0.0 110.551 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' A' ' 2' ' ' ARG . 52.8 p30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.152 -0.968 . . . . 0.0 110.18 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.415 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 79.1 mtt85 -117.11 109.93 17.55 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -1.138 . . . . 0.0 110.177 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 56.1 m -101.83 147.74 26.14 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.935 . . . . 0.0 110.319 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.4 p -87.52 -178.11 6.05 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.356 -0.84 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.4 mttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.241 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.282 0.563 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.9 tt -173.13 93.87 0.36 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.908 . . . . 0.0 110.16 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -60.02 158.32 43.96 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.843 -2.149 . . . . 0.0 110.615 0.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.68 150.1 87.11 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.733 1.386 . . . . 0.0 110.617 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.445 ' HA ' HD13 ' A' ' 10' ' ' ILE . 22.2 mm -111.43 134.05 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.319 -0.863 . . . . 0.0 110.135 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 2' ' ' ARG . 8.6 t -137.25 151.44 48.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.261 -0.9 . . . . 0.0 110.292 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -104.47 165.37 13.44 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 0.0 110.196 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.74 -11.85 22.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.741 1.39 . . . . 0.0 110.48 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.465 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 34.4 p-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.202 -0.936 . . . . 0.0 110.251 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 77.5 mtt85 -115.44 148.48 39.35 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.26 -1.141 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.2 m -135.17 156.81 48.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.265 -0.897 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -68.58 -32.98 73.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.254 -0.904 . . . . 0.0 110.221 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 tttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.224 179.951 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.202 0.525 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -171.55 92.82 0.42 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 110.144 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -60.09 157.06 46.62 Favored 'Cis proline' 0 C--N 1.31 -1.457 0 C-N-CA 121.834 -2.152 . . . . 0.0 110.573 0.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.19 151.08 81.35 Favored 'Trans proline' 0 C--N 1.312 -1.35 0 O-C-N 123.688 1.362 . . . . 0.0 110.733 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.6 tt -126.12 159.41 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.0 110.129 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 55.3 m -122.74 138.86 54.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.194 -0.942 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.437 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 41.2 m-85 -94.87 163.77 21.31 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.917 . . . . 0.0 110.25 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.437 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.56 -16.12 45.9 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.755 1.397 . . . . 0.0 110.554 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.4 p30 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.288 -0.883 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -118.37 142.72 47.25 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -1.127 . . . . 0.0 110.118 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -125.53 153.05 44.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.293 -0.879 . . . . 0.0 110.173 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.995 ' HG1' ' N ' ' A' ' 6' ' ' SER . 69.8 p -71.58 166.81 21.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.269 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.6 tttt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.995 ' N ' ' HG1' ' A' ' 4' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.221 0.534 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.763 HG23 ' O ' ' A' ' 7' ' ' ILE . 7.0 tp -157.61 100.46 1.86 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.285 -0.885 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.95 156.03 60.87 Favored 'Cis proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.688 0.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HA ' ' N ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.78 164.41 16.29 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.794 1.418 . . . . 0.0 110.551 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.3 mt -122.83 137.67 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.316 -0.865 . . . . 0.0 110.191 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.4 m -115.47 155.01 28.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 44.9 m-85 -118.55 164.3 21.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.222 -0.924 . . . . 0.0 110.143 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.38 24.01 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.641 1.338 . . . . 0.0 110.556 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.8 p30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.916 . . . . 0.0 110.223 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.0 ttt180 -127.56 135.98 51.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -1.092 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.3 m -123.31 151.43 42.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.426 ' HB ' ' OG ' ' A' ' 6' ' ' SER . 65.6 p -54.81 -44.69 74.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.261 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.225 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.568 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.205 0.526 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.7 tp -149.38 95.54 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.274 -0.891 . . . . 0.0 110.204 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.72 164.07 39.3 Favored 'Cis proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.882 -2.133 . . . . 0.0 110.611 0.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.33 149.6 88.68 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.773 1.407 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.6 mt -118.06 136.1 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.23 -0.919 . . . . 0.0 110.24 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 m -110.81 159.02 18.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.193 -0.942 . . . . 0.0 110.132 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.422 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 41.1 m-85 -125.45 159.96 57.81 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.305 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 -13.04 26.86 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.662 1.348 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -133.32 134.64 44.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.263 -1.139 . . . . 0.0 110.309 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 1.8 m -103.78 148.6 25.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.283 -0.885 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 5' ' ' LYS . 33.7 p -83.41 169.13 15.9 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.185 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 4' ' ' THR . 98.4 mttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.167 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.342 0.591 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.624 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.1 tp -162.49 93.55 1.25 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.168 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.97 162.65 45.34 Favored 'Cis proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.851 -2.145 . . . . 0.0 110.6 -0.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.82 151.6 69.82 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.605 1.318 . . . . 0.0 110.551 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 11' ' ' CYS . 9.5 tp -118.38 162.56 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' N ' HG13 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -116.22 137.64 51.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 110.247 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.471 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.1 m-85 -83.87 161.81 54.47 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.235 -0.916 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -60.8 -12.46 21.98 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 123.68 1.358 . . . . 0.0 110.563 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.2 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 110.258 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.416 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 25.6 ttt85 -88.16 95.91 10.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -1.171 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' CB ' ' A' ' 11' ' ' CYS . 40.2 m -103.72 148.2 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -0.902 . . . . 0.0 110.179 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.5 p -113.0 170.65 8.05 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.178 -0.951 . . . . 0.0 110.261 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 tttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.247 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.487 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 58.8 m . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.389 0.614 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -141.19 95.62 7.39 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.196 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -62.08 162.6 46.19 Favored 'Cis proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.923 -2.116 . . . . 0.0 110.548 -0.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.487 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 150.86 83.58 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.646 1.34 . . . . 0.0 110.555 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.5 mt -123.85 139.44 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.944 . . . . 0.0 110.206 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.462 ' CB ' ' HA ' ' A' ' 3' ' ' CYS . 51.4 t -131.31 157.49 43.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 110.234 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -104.22 164.55 15.06 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.211 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -17.54 54.04 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.635 1.334 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.906 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.445 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 94.2 mtt-85 -118.74 144.39 46.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.174 -1.192 . . . . 0.0 110.12 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.2 m -132.15 153.86 50.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.472 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 57.9 p -51.1 -44.37 61.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.208 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 52.7 tttm . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.207 179.986 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 1.4 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.285 0.564 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 6' ' ' SER . 29.6 mt -154.19 96.75 2.66 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.341 -0.849 . . . . 0.0 110.22 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.415 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.7 150.87 65.72 Favored 'Cis proline' 0 C--N 1.312 -1.358 0 C-N-CA 121.953 -2.103 . . . . 0.0 110.584 -0.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -62.15 154.02 65.56 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.613 1.323 . . . . 0.0 110.509 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.431 ' HB ' HG23 ' A' ' 4' ' ' THR . 51.6 mt -118.58 143.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -0.898 . . . . 0.0 110.175 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 17.5 m -125.04 150.6 46.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.296 -0.878 . . . . 0.0 110.215 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.474 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 23.9 m-85 -112.76 160.87 29.07 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.273 -0.892 . . . . 0.0 110.29 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.49 -15.46 41.34 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.66 1.347 . . . . 0.0 110.608 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 50.0 p30 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.268 -0.895 . . . . 0.0 110.219 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -117.75 146.79 43.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -1.147 . . . . 0.0 110.202 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 94.4 m -130.86 160.17 35.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 110.172 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.943 ' HG1' ' N ' ' A' ' 6' ' ' SER . 34.6 p -87.27 -179.49 6.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.293 -0.879 . . . . 0.0 110.344 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 35.7 tttm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.172 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.943 ' N ' ' HG1' ' A' ' 4' ' ' THR . 1.8 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.264 0.554 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 7' ' ' ILE . 7.0 pt -143.94 101.54 4.93 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.276 -0.89 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -63.4 148.96 66.13 Favored 'Cis proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.127 -2.03 . . . . 0.0 110.536 -0.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_endo -62.88 152.68 77.67 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.688 1.362 . . . . 0.0 110.56 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' CB ' ' A' ' 6' ' ' SER . 29.2 mm -109.46 136.36 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.08 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 94.8 m -121.96 148.68 44.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.882 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.423 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 28.6 m-85 -109.54 165.04 13.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.56 -12.84 26.38 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.724 1.381 . . . . 0.0 110.579 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.6 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.256 -0.903 . . . . 0.0 110.162 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -126.88 141.53 51.79 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.325 -1.103 . . . . 0.0 110.204 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 95.1 m -118.92 162.45 18.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.201 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.461 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 37.2 p -96.61 165.93 11.91 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.255 -0.903 . . . . 0.0 110.185 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.7 tttt . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.031 -0.985 . . . . 0.0 110.196 179.995 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.533 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.225 0.535 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.593 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.4 tt -156.75 93.5 2.36 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.219 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.51 156.2 57.45 Favored 'Cis proline' 0 C--N 1.311 -1.415 0 C-N-CA 121.855 -2.144 . . . . 0.0 110.589 0.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.43 154.33 59.81 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.7 1.368 . . . . 0.0 110.51 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.522 HD13 ' O ' ' A' ' 9' ' ' PRO . 23.4 mm -114.71 139.34 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.283 -0.886 . . . . 0.0 110.233 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 49.9 m -103.47 155.38 18.55 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.278 -0.889 . . . . 0.0 110.184 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -121.0 159.02 50.94 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.22 -0.925 . . . . 0.0 110.262 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.37 -12.95 26.16 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.731 1.385 . . . . 0.0 110.545 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.27 -0.894 . . . . 0.0 110.19 179.99 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.6 mtt-85 -125.7 141.67 51.9 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.305 -1.114 . . . . 0.0 110.22 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 84.8 m -125.89 160.59 29.53 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.189 -0.944 . . . . 0.0 110.217 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 63.5 p -93.23 161.52 14.38 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.307 -0.87 . . . . 0.0 110.199 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 28.3 tttt . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.222 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 75.1 m . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 121.249 0.547 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.669 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.5 OUTLIER -172.45 93.23 0.39 Allowed Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.269 -0.894 . . . . 0.0 110.153 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.438 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.41 151.04 57.08 Favored 'Cis proline' 0 C--N 1.31 -1.462 0 C-N-CA 121.903 -2.124 . . . . 0.0 110.503 -0.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.57 140.02 84.63 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.724 1.381 . . . . 0.0 110.51 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.9 mt -96.92 136.46 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.176 -0.953 . . . . 0.0 110.202 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -120.0 153.64 35.69 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.261 -0.9 . . . . 0.0 110.231 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.453 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.8 m-85 -115.84 161.97 27.89 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.897 . . . . 0.0 110.134 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.51 -11.94 22.24 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.709 1.373 . . . . 0.0 110.498 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.4 p30 . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.201 -0.937 . . . . 0.0 110.226 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.376 -1.49 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.42 ' O ' ' HA ' ' A' ' 11' ' ' CYS . 8.9 tpt180 -99.53 134.06 42.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.238 -1.154 . . . . 0.0 110.221 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 46.1 m -126.45 157.98 37.21 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.208 -0.933 . . . . 0.0 110.24 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.43 ' C ' ' HG3' ' A' ' 5' ' ' LYS . 44.1 p -113.75 166.18 11.81 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.205 -0.935 . . . . 0.0 110.261 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.43 ' HG3' ' C ' ' A' ' 4' ' ' THR . 54.3 mttm . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.177 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.524 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 121.261 0.553 . . . . 0.0 110.243 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.491 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -147.1 93.97 4.65 Favored Pre-proline 0 N--CA 1.49 1.573 0 O-C-N 121.201 -0.937 . . . . 0.0 110.199 -179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.8 161.79 46.97 Favored 'Cis proline' 0 C--N 1.311 -1.433 0 C-N-CA 121.845 -2.148 . . . . 0.0 110.539 -0.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.524 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 157.69 40.52 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.664 1.35 . . . . 0.0 110.533 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 61.4 mt -111.85 136.37 48.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.263 -0.898 . . . . 0.0 110.199 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 2' ' ' ARG . 72.6 m -126.24 150.47 48.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 110.206 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -109.17 164.72 14.08 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.215 -0.928 . . . . 0.0 110.195 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.43 -16.57 48.26 Favored 'Trans proline' 0 C--N 1.311 -1.407 0 O-C-N 123.705 1.371 . . . . 0.0 110.59 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.6 p30 . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.202 -0.936 . . . . 0.0 110.238 -179.992 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.7 mtp180 -121.86 147.51 45.89 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.259 -1.142 . . . . 0.0 110.16 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 88.2 m -128.19 160.82 30.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.231 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 76.9 p -86.65 164.79 16.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.289 -0.882 . . . . 0.0 110.224 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.2 tttt . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.182 -179.945 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 121.284 0.564 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.452 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.8 OUTLIER -173.24 94.42 0.35 Allowed Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.277 -0.889 . . . . 0.0 110.198 -179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.8 153.78 61.09 Favored 'Cis proline' 0 C--N 1.311 -1.429 0 C-N-CA 121.883 -2.132 . . . . 0.0 110.542 0.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -61.18 158.58 34.24 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.747 1.393 . . . . 0.0 110.559 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 9' ' ' PRO . 27.0 mm -114.04 142.35 26.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.228 -0.92 . . . . 0.0 110.179 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 65.3 m -121.97 147.94 45.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.268 -0.895 . . . . 0.0 110.226 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 24.4 m-85 -108.89 161.7 22.71 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.194 -0.941 . . . . 0.0 110.229 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.449 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -13.7 30.82 Favored 'Trans proline' 0 C--N 1.312 -1.385 0 O-C-N 123.621 1.327 . . . . 0.0 110.499 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 48.1 p30 . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.302 -0.874 . . . . 0.0 110.196 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 65.3 ttt180 -119.14 140.1 50.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.286 -1.126 . . . . 0.0 110.24 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.7 m -127.1 165.23 19.91 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.214 -0.929 . . . . 0.0 110.274 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 51.5 p -107.04 166.94 10.24 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.341 -0.849 . . . . 0.0 110.211 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.25 -179.95 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 88.9 p . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.201 0.524 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.515 ' N ' ' O ' ' A' ' 8' ' ' PRO . 1.2 pp -139.14 95.49 9.37 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.288 -0.882 . . . . 0.0 110.193 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.49 165.77 38.21 Favored 'Cis proline' 0 C--N 1.313 -1.337 0 C-N-CA 121.884 -2.132 . . . . 0.0 110.509 -0.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.06 146.53 97.58 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.725 1.381 . . . . 0.0 110.516 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.6 mm -110.51 145.61 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.251 -0.906 . . . . 0.0 110.212 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -120.36 155.92 32.39 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.164 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.469 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.0 m-85 -115.1 161.59 28.63 Favored Pre-proline 0 N--CA 1.49 1.565 0 O-C-N 121.257 -0.902 . . . . 0.0 110.253 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.23 -12.73 24.71 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.683 1.359 . . . . 0.0 110.593 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.469 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.8 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.256 -0.903 . . . . 0.0 110.137 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 109.466 -1.454 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 49.9 ttp85 -116.13 140.5 49.22 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.239 -1.153 . . . . 0.0 110.214 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 70.1 m -126.0 155.46 41.4 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.247 -0.908 . . . . 0.0 110.229 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 68.0 p -95.88 169.0 10.3 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.32 -0.863 . . . . 0.0 110.197 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.6 mttt . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.161 -179.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.184 0.516 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.513 ' N ' ' O ' ' A' ' 8' ' ' PRO . 18.4 mm -149.54 95.17 3.79 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.23 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.2 164.99 39.04 Favored 'Cis proline' 0 C--N 1.312 -1.359 0 C-N-CA 121.908 -2.122 . . . . 0.0 110.517 0.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.485 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.1 Cg_exo -60.39 150.93 78.01 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.743 1.391 . . . . 0.0 110.551 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.6 mt -113.28 143.03 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.206 -0.934 . . . . 0.0 110.283 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 68.3 m -119.44 152.59 36.61 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.223 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 18.3 m-85 -108.03 159.69 29.62 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.222 -0.924 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.36 -12.2 22.84 Favored 'Trans proline' 0 C--N 1.312 -1.372 0 O-C-N 123.652 1.343 . . . . 0.0 110.521 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.447 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.9 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.254 -0.903 . . . . 0.0 110.234 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.315 0 N-CA-C 109.418 -1.473 . . . . 0.0 109.418 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.446 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 24.4 mmt85 -115.84 141.91 47.47 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.23 -1.159 . . . . 0.0 110.192 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.0 m -129.43 158.87 37.98 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.196 -0.94 . . . . 0.0 110.187 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 5' ' ' LYS . 67.8 p -70.89 159.54 34.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.289 -0.882 . . . . 0.0 110.235 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.405 ' C ' ' O ' ' A' ' 4' ' ' THR . 24.6 mttm . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.59 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 30.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.204 0.526 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.506 ' N ' ' O ' ' A' ' 8' ' ' PRO . 2.7 mp -139.2 96.59 8.9 Favored Pre-proline 0 N--CA 1.491 1.598 0 O-C-N 121.308 -0.87 . . . . 0.0 110.191 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.82 165.56 35.12 Favored 'Cis proline' 0 C--N 1.312 -1.345 0 C-N-CA 121.939 -2.109 . . . . 0.0 110.541 0.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.59 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.46 150.7 84.01 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.71 1.374 . . . . 0.0 110.505 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.0 mt -112.17 141.39 27.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.182 -0.949 . . . . 0.0 110.179 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 52.8 m -121.24 154.33 36.45 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.273 -0.892 . . . . 0.0 110.244 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.7 m-85 -115.02 161.53 28.78 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.92 . . . . 0.0 110.179 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.33 23.4 Favored 'Trans proline' 0 C--N 1.312 -1.368 0 O-C-N 123.714 1.376 . . . . 0.0 110.58 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.492 1.651 0 O-C-N 121.341 -0.849 . . . . 0.0 110.204 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 41.0 mtm180 -115.4 149.53 37.83 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.263 -1.139 . . . . 0.0 110.153 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 20.6 m -127.41 156.11 42.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 110.213 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.77 -27.81 63.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.178 -0.951 . . . . 0.0 110.287 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.468 ' HE3' ' CG ' ' A' ' 9' ' ' PRO . 21.9 mttt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.185 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 7' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.264 0.554 . . . . 0.0 110.233 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.514 ' N ' ' O ' ' A' ' 8' ' ' PRO . 4.4 mt -139.27 95.56 9.22 Favored Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.245 -0.91 . . . . 0.0 110.275 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.43 166.06 36.97 Favored 'Cis proline' 0 C--N 1.311 -1.426 0 C-N-CA 121.886 -2.131 . . . . 0.0 110.602 0.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' CG ' ' HE3' ' A' ' 5' ' ' LYS . 3.0 Cg_exo -60.7 156.49 42.46 Favored 'Trans proline' 0 C--N 1.31 -1.464 0 O-C-N 123.666 1.351 . . . . 0.0 110.483 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.4 mt -115.39 140.05 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 99.0 m -122.35 158.64 29.17 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.254 -0.904 . . . . 0.0 110.233 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 16.8 m-85 -116.27 159.23 40.6 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.288 -0.883 . . . . 0.0 110.162 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.94 -13.38 26.93 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.699 1.368 . . . . 0.0 110.505 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.7 p30 . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.224 -0.923 . . . . 0.0 110.193 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.442 -1.463 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 73.5 mtt85 -124.97 136.86 54.13 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.242 -1.152 . . . . 0.0 110.222 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.5 m -125.41 158.85 33.3 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.26 -0.9 . . . . 0.0 110.174 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.479 ' CB ' ' OG ' ' A' ' 6' ' ' SER . 32.2 p -86.82 160.65 18.7 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.23 -0.919 . . . . 0.0 110.207 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.4 mttm . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.911 -1.042 . . . . 0.0 110.257 179.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.491 ' O ' HD13 ' A' ' 7' ' ' ILE . 7.4 m . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.256 0.55 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.521 ' N ' ' O ' ' A' ' 8' ' ' PRO . 35.7 mm -147.66 96.11 4.16 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.181 -0.949 . . . . 0.0 110.249 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 2.8 Cg_endo -62.47 166.93 34.46 Favored 'Cis proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.925 -2.115 . . . . 0.0 110.661 -0.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.8 153.52 62.19 Favored 'Trans proline' 0 C--N 1.309 -1.516 0 O-C-N 123.734 1.387 . . . . 0.0 110.498 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.2 mt -117.98 134.13 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 13.6 m -103.88 162.47 13.09 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.233 -0.917 . . . . 0.0 110.133 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.0 m-85 -124.19 154.62 68.57 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.193 -0.942 . . . . 0.0 110.18 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.75 -15.37 37.21 Favored 'Trans proline' 0 C--N 1.311 -1.417 0 O-C-N 123.727 1.383 . . . . 0.0 110.546 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.47 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 41.6 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.275 -0.89 . . . . 0.0 110.139 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.453 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 36.7 ttt180 -112.23 138.09 49.41 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.203 -1.175 . . . . 0.0 110.261 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.7 m -122.98 158.48 30.39 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.88 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 73.4 p -112.76 168.34 9.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.359 -0.838 . . . . 0.0 110.219 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.46 ' OXT' ' HB3' ' A' ' 6' ' ' SER . 24.4 mttm . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 118.054 -0.974 . . . . 0.0 110.223 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.604 ' C ' HG23 ' A' ' 7' ' ' ILE . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.276 0.56 . . . . 0.0 110.196 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.604 HG23 ' C ' ' A' ' 6' ' ' SER . 1.1 pp -156.51 97.51 2.17 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.245 -0.909 . . . . 0.0 110.219 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.424 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.89 158.38 56.54 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.979 -2.092 . . . . 0.0 110.606 -0.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.25 157.36 40.51 Favored 'Trans proline' 0 C--N 1.31 -1.458 0 O-C-N 123.745 1.392 . . . . 0.0 110.603 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.3 mt -121.6 131.43 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.217 -0.927 . . . . 0.0 110.206 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 95.2 m -117.63 156.84 27.46 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.244 -0.91 . . . . 0.0 110.251 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.4 m-85 -111.99 161.97 23.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.205 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.48 -12.66 25.29 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.671 1.353 . . . . 0.0 110.568 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 46.0 p30 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.88 . . . . 0.0 110.13 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 109.546 -1.422 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 56.9 mtm-85 -127.9 133.37 49.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.232 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.44 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -110.42 151.68 27.2 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.929 . . . . 0.0 110.32 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.488 ' O ' ' CG ' ' A' ' 5' ' ' LYS . 60.2 p -85.54 175.84 8.57 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.207 -0.933 . . . . 0.0 110.201 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' CG ' ' O ' ' A' ' 4' ' ' THR . 32.7 mttt . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 117.966 -1.016 . . . . 0.0 110.212 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 74.4 p . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.215 0.531 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.449 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.3 tt -156.74 94.59 2.28 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.299 -0.876 . . . . 0.0 110.254 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.435 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.22 153.49 56.95 Favored 'Cis proline' 0 C--N 1.311 -1.439 0 C-N-CA 121.935 -2.11 . . . . 0.0 110.594 -0.037 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.46 156.5 46.32 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.682 1.359 . . . . 0.0 110.572 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 85.7 mt -125.13 133.14 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.177 -0.952 . . . . 0.0 110.204 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 2' ' ' ARG . 6.6 t -117.39 162.52 17.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.258 -0.901 . . . . 0.0 110.337 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.468 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.7 m-85 -116.8 162.05 29.16 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.235 -0.915 . . . . 0.0 110.226 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.468 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.33 -15.47 40.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.716 1.377 . . . . 0.0 110.444 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 50.0 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.275 -0.891 . . . . 0.0 110.116 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.274 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' A' ' 14' ' ' ASP . 47.1 mtm180 -122.46 138.88 54.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.196 -1.179 . . . . 0.0 110.213 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 94.4 m -120.58 161.03 22.03 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.16 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -66.3 -29.99 70.31 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.7 ttpp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.276 179.957 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.509 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 57.0 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.288 0.566 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.543 HG23 ' O ' ' A' ' 7' ' ' ILE . 2.4 tp -146.84 96.34 4.37 Favored Pre-proline 0 N--CA 1.49 1.575 0 O-C-N 121.257 -0.902 . . . . 0.0 110.217 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.3 164.47 35.55 Favored 'Cis proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.889 -2.13 . . . . 0.0 110.671 0.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -60.92 160.27 26.17 Favored 'Trans proline' 0 C--N 1.311 -1.399 0 O-C-N 123.64 1.337 . . . . 0.0 110.565 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 25.9 mm -112.31 136.7 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.231 -0.918 . . . . 0.0 110.264 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 18.3 m -118.62 159.53 23.44 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.289 -0.882 . . . . 0.0 110.199 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -125.89 159.11 63.17 Favored Pre-proline 0 N--CA 1.491 1.62 0 O-C-N 121.178 -0.951 . . . . 0.0 110.181 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.76 -11.72 22.04 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.654 1.344 . . . . 0.0 110.551 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' A' ' 2' ' ' ARG . 52.8 p30 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.152 -0.968 . . . . 0.0 110.18 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.264 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 79.1 mtt85 -117.11 109.93 17.55 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -1.138 . . . . 0.0 110.177 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 56.1 m -101.83 147.74 26.14 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.205 -0.935 . . . . 0.0 110.319 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.4 p -87.52 -178.11 6.05 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.356 -0.84 . . . . 0.0 110.172 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.4 mttt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.241 179.978 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.282 0.563 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.652 HG23 ' O ' ' A' ' 7' ' ' ILE . 4.9 tt -173.13 93.87 0.36 Allowed Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.248 -0.908 . . . . 0.0 110.16 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -60.02 158.32 43.96 Favored 'Cis proline' 0 C--N 1.311 -1.428 0 C-N-CA 121.843 -2.149 . . . . 0.0 110.615 0.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.68 150.1 87.11 Favored 'Trans proline' 0 C--N 1.312 -1.386 0 O-C-N 123.733 1.386 . . . . 0.0 110.617 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.445 ' HA ' HD13 ' A' ' 10' ' ' ILE . 22.2 mm -111.43 134.05 55.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.319 -0.863 . . . . 0.0 110.135 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' SG ' ' C ' ' A' ' 2' ' ' ARG . 8.6 t -137.25 151.44 48.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.261 -0.9 . . . . 0.0 110.292 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 32.5 m-85 -104.47 165.37 13.44 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.261 -0.899 . . . . 0.0 110.196 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.1 Cg_exo -61.74 -11.85 22.57 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.741 1.39 . . . . 0.0 110.48 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.465 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 34.4 p-10 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.202 -0.936 . . . . 0.0 110.251 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 77.5 mtt85 -115.44 148.48 39.35 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.26 -1.141 . . . . 0.0 110.17 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.2 m -135.17 156.81 48.35 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.265 -0.897 . . . . 0.0 110.151 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.8 p -68.58 -32.98 73.28 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.254 -0.904 . . . . 0.0 110.221 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.9 tttp . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.224 179.951 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.202 0.525 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.685 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -171.55 92.82 0.42 Allowed Pre-proline 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.882 . . . . 0.0 110.144 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -60.09 157.06 46.62 Favored 'Cis proline' 0 C--N 1.31 -1.457 0 C-N-CA 121.834 -2.152 . . . . 0.0 110.573 0.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.19 151.08 81.35 Favored 'Trans proline' 0 C--N 1.312 -1.35 0 O-C-N 123.688 1.362 . . . . 0.0 110.733 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.6 tt -126.12 159.41 34.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.268 -0.895 . . . . 0.0 110.129 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 55.3 m -122.74 138.86 54.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.194 -0.942 . . . . 0.0 110.215 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.437 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 41.2 m-85 -94.87 163.77 21.31 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.232 -0.917 . . . . 0.0 110.25 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.437 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.56 -16.12 45.9 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.755 1.397 . . . . 0.0 110.554 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.4 p30 . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.288 -0.883 . . . . 0.0 110.187 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -118.37 142.72 47.25 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.284 -1.127 . . . . 0.0 110.118 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -125.53 153.05 44.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.293 -0.879 . . . . 0.0 110.173 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.995 ' HG1' ' N ' ' A' ' 6' ' ' SER . 69.8 p -71.58 166.81 21.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.919 . . . . 0.0 110.269 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 83.6 tttt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.924 -1.036 . . . . 0.0 110.197 179.976 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.995 ' N ' ' HG1' ' A' ' 4' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.221 0.534 . . . . 0.0 110.258 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.763 HG23 ' O ' ' A' ' 7' ' ' ILE . 7.0 tp -157.61 100.46 1.86 Allowed Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.285 -0.885 . . . . 0.0 110.153 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.95 156.03 60.87 Favored 'Cis proline' 0 C--N 1.312 -1.349 0 C-N-CA 122.073 -2.053 . . . . 0.0 110.688 0.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HA ' ' N ' ' A' ' 6' ' ' SER . 2.9 Cg_endo -61.78 164.41 16.29 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.794 1.418 . . . . 0.0 110.551 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.3 mt -122.83 137.67 55.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.316 -0.865 . . . . 0.0 110.191 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.4 m -115.47 155.01 28.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.298 -0.876 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.407 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 44.9 m-85 -118.55 164.3 21.26 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.222 -0.924 . . . . 0.0 110.143 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.38 24.01 Favored 'Trans proline' 0 C--N 1.312 -1.389 0 O-C-N 123.641 1.338 . . . . 0.0 110.556 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 55.8 p30 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.916 . . . . 0.0 110.223 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.3 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.0 ttt180 -127.56 135.98 51.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.344 -1.092 . . . . 0.0 110.219 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.3 m -123.31 151.43 42.44 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.242 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.426 ' HB ' ' OG ' ' A' ' 6' ' ' SER . 65.6 p -54.81 -44.69 74.06 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.0 110.261 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.225 -179.983 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.568 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.205 0.526 . . . . 0.0 110.186 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.627 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.7 tp -149.38 95.54 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.274 -0.891 . . . . 0.0 110.204 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.509 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.72 164.07 39.3 Favored 'Cis proline' 0 C--N 1.312 -1.369 0 C-N-CA 121.882 -2.133 . . . . 0.0 110.611 0.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.568 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -61.33 149.6 88.68 Favored 'Trans proline' 0 C--N 1.311 -1.432 0 O-C-N 123.773 1.407 . . . . 0.0 110.528 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.6 mt -118.06 136.1 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.23 -0.919 . . . . 0.0 110.24 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.5 m -110.81 159.02 18.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.193 -0.942 . . . . 0.0 110.132 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.422 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 41.1 m-85 -125.45 159.96 57.81 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.31 -0.869 . . . . 0.0 110.305 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 -13.04 26.86 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.662 1.348 . . . . 0.0 110.578 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.491 1.611 0 O-C-N 121.249 -0.907 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.295 0 N-CA-C 109.465 -1.454 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -133.32 134.64 44.07 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.263 -1.139 . . . . 0.0 110.309 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 1.8 m -103.78 148.6 25.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.283 -0.885 . . . . 0.0 110.164 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.427 ' O ' ' C ' ' A' ' 5' ' ' LYS . 33.7 p -83.41 169.13 15.9 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.898 . . . . 0.0 110.185 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 4' ' ' THR . 98.4 mttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.167 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.342 0.591 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.624 HG23 ' O ' ' A' ' 7' ' ' ILE . 1.1 tp -162.49 93.55 1.25 Allowed Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.406 -0.809 . . . . 0.0 110.168 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.521 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.97 162.65 45.34 Favored 'Cis proline' 0 C--N 1.312 -1.371 0 C-N-CA 121.851 -2.145 . . . . 0.0 110.6 -0.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.82 151.6 69.82 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.605 1.318 . . . . 0.0 110.551 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 11' ' ' CYS . 9.5 tp -118.38 162.56 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' N ' HG13 ' A' ' 10' ' ' ILE . 0.1 OUTLIER -116.22 137.64 51.97 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 110.247 179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.471 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 20.1 m-85 -83.87 161.81 54.47 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.235 -0.916 . . . . 0.0 110.205 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -60.8 -12.46 21.98 Favored 'Trans proline' 0 C--N 1.311 -1.411 0 O-C-N 123.68 1.358 . . . . 0.0 110.563 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 49.2 p30 . . . . . 0 N--CA 1.491 1.604 0 O-C-N 121.286 -0.884 . . . . 0.0 110.258 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.32 0 N-CA-C 109.457 -1.457 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.416 ' C ' ' SG ' ' A' ' 11' ' ' CYS . 25.6 ttt85 -88.16 95.91 10.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.21 -1.171 . . . . 0.0 110.203 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.462 ' HA ' ' CB ' ' A' ' 11' ' ' CYS . 40.2 m -103.72 148.2 26.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -0.902 . . . . 0.0 110.179 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.5 p -113.0 170.65 8.05 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.178 -0.951 . . . . 0.0 110.261 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 tttt . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.247 179.972 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.487 ' CA ' ' HA ' ' A' ' 9' ' ' PRO . 58.8 m . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.389 0.614 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.525 HG23 ' O ' ' A' ' 7' ' ' ILE . 0.9 OUTLIER -141.19 95.62 7.39 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.196 179.993 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' N ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -62.08 162.6 46.19 Favored 'Cis proline' 0 C--N 1.311 -1.4 0 C-N-CA 121.923 -2.116 . . . . 0.0 110.548 -0.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.487 ' HA ' ' CA ' ' A' ' 6' ' ' SER . 3.0 Cg_endo -61.57 150.86 83.58 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.646 1.34 . . . . 0.0 110.555 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 84.5 mt -123.85 139.44 50.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.189 -0.944 . . . . 0.0 110.206 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.462 ' CB ' ' HA ' ' A' ' 3' ' ' CYS . 51.4 t -131.31 157.49 43.19 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 110.234 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -104.22 164.55 15.06 Favored Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.258 -0.901 . . . . 0.0 110.211 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -17.54 54.04 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.635 1.334 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 54.0 p30 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.906 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.402 -1.479 . . . . 0.0 109.402 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.445 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 94.2 mtt-85 -118.74 144.39 46.29 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.174 -1.192 . . . . 0.0 110.12 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.2 m -132.15 153.86 50.1 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.472 ' OG1' ' HB3' ' A' ' 6' ' ' SER . 57.9 p -51.1 -44.37 61.25 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.249 -0.907 . . . . 0.0 110.208 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 52.7 tttm . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.003 -0.998 . . . . 0.0 110.207 179.986 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 9' ' ' PRO . 1.4 p . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.285 0.564 . . . . 0.0 110.204 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 6' ' ' SER . 29.6 mt -154.19 96.75 2.66 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.341 -0.849 . . . . 0.0 110.22 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.415 ' C ' ' CA ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -62.7 150.87 65.72 Favored 'Cis proline' 0 C--N 1.312 -1.358 0 C-N-CA 121.953 -2.103 . . . . 0.0 110.584 -0.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 6' ' ' SER . 3.0 Cg_exo -62.15 154.02 65.56 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 O-C-N 123.613 1.323 . . . . 0.0 110.509 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.431 ' HB ' HG23 ' A' ' 4' ' ' THR . 51.6 mt -118.58 143.29 29.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -0.898 . . . . 0.0 110.175 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 17.5 m -125.04 150.6 46.6 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.296 -0.878 . . . . 0.0 110.215 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.474 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 23.9 m-85 -112.76 160.87 29.07 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.273 -0.892 . . . . 0.0 110.29 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.49 -15.46 41.34 Favored 'Trans proline' 0 C--N 1.311 -1.434 0 O-C-N 123.66 1.347 . . . . 0.0 110.608 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 50.0 p30 . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.268 -0.895 . . . . 0.0 110.219 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 78.2 mtt85 -117.75 146.79 43.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.25 -1.147 . . . . 0.0 110.202 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 94.4 m -130.86 160.17 35.22 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.216 -0.927 . . . . 0.0 110.172 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.943 ' HG1' ' N ' ' A' ' 6' ' ' SER . 34.6 p -87.27 -179.49 6.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.293 -0.879 . . . . 0.0 110.344 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.431 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 35.7 tttm . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.172 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.943 ' N ' ' HG1' ' A' ' 4' ' ' THR . 1.8 m . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.264 0.554 . . . . 0.0 110.238 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 7' ' ' ILE . 7.0 pt -143.94 101.54 4.93 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.276 -0.89 . . . . 0.0 110.175 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -63.4 148.96 66.13 Favored 'Cis proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.127 -2.03 . . . . 0.0 110.536 -0.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.9 Cg_endo -62.88 152.68 77.67 Favored 'Trans proline' 0 C--N 1.312 -1.357 0 O-C-N 123.688 1.362 . . . . 0.0 110.56 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.515 HG12 ' CB ' ' A' ' 6' ' ' SER . 29.2 mm -109.46 136.36 45.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.08 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 94.8 m -121.96 148.68 44.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.288 -0.882 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.423 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 28.6 m-85 -109.54 165.04 13.39 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.56 -12.84 26.38 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.724 1.381 . . . . 0.0 110.579 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.6 p30 . . . . . 0 N--CA 1.492 1.647 0 O-C-N 121.256 -0.903 . . . . 0.0 110.162 -179.959 . . . . . . . . 0 0 . 1 stop_ save_