data_1e75_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 1e75 _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 1.469 0.85 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.441 ' C ' ' H ' ' A' ' 4' ' ' SER . 0.8 OUTLIER -59.12 -22.72 61.31 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 126.319 1.848 . . . . 0.0 115.307 -168.304 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -66.4 13.5 0.05 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.395 1.452 . . . . 0.0 113.421 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 2' ' ' CYS . 18.8 p -96.18 -69.95 0.73 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.593 1.557 . . . . 0.0 109.627 175.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -72.51 127.61 89.76 Favored Pre-proline 0 N--CA 1.452 -0.35 0 C-N-CA 123.657 0.783 . . . . 0.0 110.093 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -66.42 -10.53 28.01 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.615 2.21 . . . . 0.0 113.452 -173.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.0 -20.35 61.03 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 109.5 177.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.4 t -124.69 -13.88 6.89 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.7 1.2 . . . . 0.0 112.786 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.92 67.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -162.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -24.31 62.73 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 120.305 1.411 . . . . 0.0 113.14 -175.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -163.71 66.83 0.17 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -173.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 CA--C 1.531 0.224 0 C-N-CA 118.919 -1.113 . . . . 0.0 108.076 159.783 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.935 0 N-CA-C 110.366 -1.093 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.4 t -145.7 -47.68 0.22 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.997 0.899 . . . . 0.0 110.286 159.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.7 m -52.97 -28.02 21.85 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.179 0.592 . . . . 0.0 110.91 172.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -75.54 -26.26 57.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.616 2.367 . . . . 0.0 115.961 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -111.35 117.04 50.16 Favored Pre-proline 0 N--CA 1.435 -1.202 0 CA-C-N 120.285 1.402 . . . . 0.0 108.381 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.55 3.63 1.71 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.857 2.371 . . . . 0.0 113.942 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.06 -27.66 61.02 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.567 164.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.1 p -133.77 10.3 3.96 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.187 1.358 . . . . 0.0 113.608 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.94 -57.65 8.0 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 120.267 1.394 . . . . 0.0 112.742 -176.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 p-90 -62.81 -20.94 65.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.788 1.177 . . . . 0.0 113.056 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -22.06 55.9 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.894 1.678 . . . . 0.0 110.349 177.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.7 t . . . . . 0 CA--C 1.535 0.391 0 C-N-CA 127.116 2.166 . . . . 0.0 107.562 169.606 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.649 -0.58 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -8.08 5.93 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.829 2.052 . . . . 0.0 113.588 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.8 m -66.21 -18.14 65.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.076 -1.015 . . . . 0.0 112.78 168.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.9 p -93.17 -26.32 17.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.54 1.064 . . . . 0.0 113.585 -167.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -116.56 134.83 22.84 Favored Pre-proline 0 N--CA 1.444 -0.771 0 C-N-CA 125.438 1.495 . . . . 0.0 111.579 -177.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -67.19 -0.97 5.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.519 2.813 . . . . 0.0 114.921 -171.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.25 -22.61 60.37 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 119.487 1.04 . . . . 0.0 108.938 173.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.64 -17.06 2.57 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.08 -25.9 65.76 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.701 0.801 . . . . 0.0 111.789 -170.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -44.32 -13.16 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 117.754 2.501 . . . . 0.0 117.754 162.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -163.44 18.06 0.07 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.154 2.182 . . . . 0.0 111.017 171.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.544 0.748 0 C-N-CA 126.261 1.824 . . . . 0.0 112.262 -163.068 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.617 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -46.79 51.2 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 117.677 0.738 . . . . 0.0 112.003 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.8 t -66.21 -18.76 65.55 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.7 p -95.7 -47.25 6.27 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.016 1.28 . . . . 0.0 110.75 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.68 143.35 98.56 Favored Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.461 0.704 . . . . 0.0 110.583 -173.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -78.19 -11.96 16.01 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 121.034 1.156 . . . . 0.0 112.075 -166.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.83 4.1 52.65 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.611 0.764 . . . . 0.0 111.338 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -147.79 -1.52 0.59 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -32.75 72.17 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.071 -1.018 . . . . 0.0 112.16 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -59.23 -35.19 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.296 -0.878 . . . . 0.0 112.874 170.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -48.16 21.23 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 126.325 1.85 . . . . 0.0 109.898 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.7 m . . . . . 0 C--O 1.226 -0.173 0 C-N-CA 126.567 1.947 . . . . 0.0 110.302 -160.126 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.726 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -20.6 60.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -161.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 m -66.48 -14.86 62.83 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.433 1.47 . . . . 0.0 113.269 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.4 p -83.96 -61.9 1.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.013 0.824 . . . . 0.0 110.565 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -72.16 122.76 88.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.545 1.938 . . . . 0.0 110.227 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.71 169.71 13.99 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.253 1.969 . . . . 0.0 110.84 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.8 mt 77.78 -16.91 0.61 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.608 2.763 . . . . 0.0 111.597 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.2 t -116.32 -23.2 8.46 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.1 0.96 . . . . 0.0 112.18 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.34 -19.34 64.65 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -169.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -54.52 -32.93 59.06 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.254 1.022 . . . . 0.0 112.332 -176.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.07 84.21 0.44 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 104.519 -2.4 . . . . 0.0 104.519 172.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -174.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.4 m -34.04 -51.77 0.43 Allowed 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.309 2.644 . . . . 0.0 115.718 -160.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.6 m -52.38 -30.51 29.34 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -173.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -79.77 -21.6 44.2 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.085 -177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.57 144.86 31.43 Favored Pre-proline 0 N--CA 1.449 -0.513 0 CA-C-N 120.718 1.599 . . . . 0.0 112.113 -167.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.92 -3.55 14.08 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.772 2.315 . . . . 0.0 113.789 -170.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -96.0 -1.27 49.31 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.078 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -154.05 20.88 0.51 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.026 1.285 . . . . 0.0 113.365 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 30.92 0.07 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.478 1.911 . . . . 0.0 112.519 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.6 p-90 -60.94 3.41 0.09 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.393 2.277 . . . . 0.0 115.454 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 26.3 ttm105 73.48 62.7 0.09 Allowed 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 p . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 125.103 1.361 . . . . 0.0 113.257 -175.786 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.747 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 -52.47 0.13 Allowed 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 163.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -66.61 7.13 0.37 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 167.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.4 p -87.15 -119.79 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.182 2.593 . . . . 0.0 108.793 -175.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -48.06 152.09 1.54 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 129.048 2.939 . . . . 0.0 111.728 165.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.25 172.86 14.73 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.995 2.463 . . . . 0.0 111.301 -171.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt 85.61 -13.89 0.59 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 129.368 3.067 . . . . 0.0 111.374 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 t -127.97 -6.15 5.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.681 0.792 . . . . 0.0 111.779 159.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.45 96.58 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.032 -1.043 . . . . 0.0 111.398 -172.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -65.94 -23.79 66.68 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -69.37 -50.94 41.56 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.447 -0.607 0 C-N-CA 128.484 2.714 . . . . 0.0 109.681 -165.224 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.827 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -46.2 -36.67 6.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.637 1.575 . . . . 0.0 114.176 -170.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -3.81 6.4 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -96.34 -12.77 23.93 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.733 1.606 . . . . 0.0 114.803 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -112.65 140.06 23.47 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 121.321 1.873 . . . . 0.0 111.115 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -70.96 -8.58 23.93 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.002 2.468 . . . . 0.0 112.842 -173.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.9 -19.22 60.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.167 0.587 . . . . 0.0 109.968 174.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -135.4 -30.02 1.04 Allowed 'General case' 0 C--N 1.341 0.201 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -169.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.36 -11.78 60.1 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -164.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.8 p-90 -58.54 -9.31 1.58 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.862 1.665 . . . . 0.0 115.028 -170.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.33 30.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.848 2.459 . . . . 0.0 108.716 174.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 C--O 1.221 -0.397 0 C-N-CA 130.161 3.384 . . . . 0.0 113.549 -158.554 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.677 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -28.61 68.77 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -152.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.7 t -66.25 -36.91 84.24 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.89 1.223 . . . . 0.0 111.506 172.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 p -96.47 -16.99 20.86 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -167.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -114.41 146.58 36.16 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 120.275 1.398 . . . . 0.0 109.942 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.07 167.09 27.72 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 C-N-CA 121.695 1.597 . . . . 0.0 112.413 -159.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 mt 89.74 -44.5 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 131.433 3.893 . . . . 0.0 105.885 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -87.94 -23.85 23.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.814 1.646 . . . . 0.0 112.224 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.56 -40.29 68.59 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 125.33 1.452 . . . . 0.0 112.925 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.9 p-90 -55.72 -34.64 65.31 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.631 0.651 . . . . 0.0 112.038 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.2 ttt-85 -76.8 -38.39 54.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -172.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.537 0.452 0 C-N-CA 125.087 1.355 . . . . 0.0 111.471 -172.061 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.59 -13.85 62.26 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.9 m -66.1 -24.31 66.67 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.95 1.25 . . . . 0.0 111.759 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.3 p -81.56 -61.02 2.05 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 118.926 0.785 . . . . 0.0 112.312 -165.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -97.82 136.11 21.28 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 122.951 0.5 . . . . 0.0 111.687 -159.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -64.53 137.4 54.74 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.049 1.833 . . . . 0.0 108.312 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.1 mt 96.0 -2.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 1 C-N-CA 131.992 4.117 . . . . 0.0 111.536 -163.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -136.34 -27.03 1.09 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.348 1.431 . . . . 0.0 113.578 158.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -8.17 18.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 126.045 1.738 . . . . 0.0 114.837 -171.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -50.43 -34.01 23.0 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 125.467 1.507 . . . . 0.0 113.167 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.49 32.01 0.09 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.429 1.892 . . . . 0.0 109.01 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t . . . . . 0 CA--C 1.533 0.302 0 C-N-CA 123.969 0.908 . . . . 0.0 109.791 169.449 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 -10.7 1.33 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.009 0.923 . . . . 0.0 111.5 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.5 -12.95 60.04 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 119.706 -1.872 . . . . 0.0 113.416 159.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 p -73.86 -41.05 62.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.464 1.506 . . . . 0.0 113.351 178.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.53 154.01 49.04 Favored Pre-proline 0 C--N 1.325 -0.457 0 C-N-CA 127.417 2.287 . . . . 0.0 110.338 -168.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -73.63 176.32 9.51 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.629 1.553 . . . . 0.0 110.668 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt 75.33 -9.18 1.44 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.491 2.316 . . . . 0.0 111.234 173.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.3 p -129.19 -24.82 2.81 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.267 1.827 . . . . 0.0 113.167 169.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -28.48 53.13 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.739 1.216 . . . . 0.0 113.977 -172.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -46.55 -26.54 0.9 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -163.28 50.34 0.15 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.223 1.409 . . . . 0.0 108.159 169.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 m . . . . . 0 CA--C 1.536 0.423 0 C-N-CA 129.155 2.982 . . . . 0.0 114.614 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.33 6.85 1.93 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.9 m -66.35 -29.17 69.31 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.038 -1.664 . . . . 0.0 111.055 158.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -82.87 -42.82 17.31 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 125.725 1.61 . . . . 0.0 113.729 -159.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.36 153.41 48.74 Favored Pre-proline 0 N--CA 1.45 -0.441 0 C-N-CA 125.92 1.688 . . . . 0.0 110.57 -169.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.35 170.22 13.9 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.673 2.248 . . . . 0.0 112.461 -168.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.53 -14.93 0.52 Allowed 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 129.786 3.234 . . . . 0.0 112.909 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -130.36 -19.61 3.08 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 177.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.78 -35.03 42.37 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.062 1.345 . . . . 0.0 111.231 176.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.0 p-90 -52.53 -15.4 0.67 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.01 1.724 . . . . 0.0 115.45 176.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -163.17 34.2 0.09 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.283 1.033 . . . . 0.0 110.694 -178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 125.317 1.447 . . . . 0.0 113.824 -177.9 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.678 0 N-CA-C 109.086 -1.605 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -17.76 64.89 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -153.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.3 m -66.66 -29.96 70.1 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.698 1.135 . . . . 0.0 111.595 172.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.3 p -96.43 -63.87 1.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.245 1.418 . . . . 0.0 111.477 -172.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.09 139.29 97.64 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 178.23 7.24 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.991 2.461 . . . . 0.0 113.486 -158.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.06 4.63 4.91 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 127.01 2.124 . . . . 0.0 113.287 166.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.0 p -135.83 -5.79 2.17 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 169.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.83 -33.95 72.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 125.439 1.496 . . . . 0.0 113.231 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -56.35 -17.45 7.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.81 52.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.444 -0.772 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.673 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.742 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 m -54.23 -27.26 33.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -173.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -29.83 60.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.021 1.282 . . . . 0.0 112.672 -178.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.5 p -92.14 -10.43 38.88 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.47 105.57 51.94 Favored Pre-proline 0 N--CA 1.441 -0.889 0 CA-C-N 120.933 1.697 . . . . 0.0 111.208 -174.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.3 145.01 98.86 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.27 1.98 . . . . 0.0 109.672 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt 96.96 -40.28 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 1 C-N-CA 133.363 4.665 . . . . 0.0 107.301 -158.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 t -105.07 -15.5 15.07 Favored 'General case' 0 N--CA 1.46 0.046 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.35 -49.3 76.6 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.388 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -26.15 68.54 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 177.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -28.37 58.22 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.074 0.95 . . . . 0.0 110.008 -178.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 161.221 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.621 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -63.5 -17.35 62.66 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -158.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.6 m -63.18 -19.85 64.87 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.125 1.33 . . . . 0.0 111.143 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -78.59 -53.1 7.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 118.936 0.789 . . . . 0.0 111.028 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -104.95 148.97 37.01 Favored Pre-proline 0 N--CA 1.451 -0.408 0 C-N-CA 124.115 0.966 . . . . 0.0 111.846 -159.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 8' ' ' CYS . 77.4 Cg_endo -74.88 166.2 29.76 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.016 1.81 . . . . 0.0 111.431 -165.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.3 mt 74.44 -22.26 0.26 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.239 3.015 . . . . 0.0 110.64 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.484 ' H ' ' C ' ' A' ' 6' ' ' PRO . 2.7 t -113.37 -16.98 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.662 1.585 . . . . 0.0 112.302 -175.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.84 -51.3 67.99 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 124.484 1.113 . . . . 0.0 112.012 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -22.7 66.81 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 118.754 0.706 . . . . 0.0 112.888 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 ttp-105 -76.84 -30.95 56.55 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.493 0.588 . . . . 0.0 111.746 174.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 N--CA 1.447 -0.594 0 CA-C-N 118.614 0.643 . . . . 0.0 109.492 173.608 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.22 -35.45 0.24 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.292 1.037 . . . . 0.0 109.493 147.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.5 m -65.84 -37.35 85.98 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.35 -0.844 . . . . 0.0 111.405 176.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -74.16 -71.53 0.33 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 127.049 2.14 . . . . 0.0 110.629 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.99 120.5 58.12 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 124.651 1.181 . . . . 0.0 110.608 -174.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -63.08 157.37 49.54 Favored 'Trans proline' 0 N--CA 1.448 -1.158 0 C-N-CA 121.884 1.722 . . . . 0.0 109.494 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 56.1 mt 89.91 -21.93 0.12 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 131.379 3.871 . . . . 0.0 110.444 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 t -113.26 -8.08 13.52 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.157 0.89 . . . . 0.0 112.733 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.38 87.15 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.521 -0.737 . . . . 0.0 111.627 -175.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -62.18 -29.18 70.18 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 174.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -76.55 -32.52 58.24 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 124.591 1.156 . . . . 0.0 112.006 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.2 t . . . . . 0 CA--C 1.535 0.372 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 168.449 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.732 0 CA-C-O 119.025 -0.875 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.18 -51.16 46.14 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.118 0.967 . . . . 0.0 112.823 -168.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.1 m -56.54 -27.91 58.75 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -96.31 -17.81 20.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.92 132.64 21.81 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 120.724 1.602 . . . . 0.0 110.405 -168.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -59.48 129.38 30.89 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.93 2.42 . . . . 0.0 110.851 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.0 mt 93.51 -16.23 0.12 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 131.682 3.993 . . . . 0.0 111.39 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -110.42 -12.62 14.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.963 1.71 . . . . 0.0 112.931 165.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.64 79.91 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.685 -0.635 . . . . 0.0 110.26 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.2 p-90 -60.73 -19.95 60.05 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -76.1 -4.74 43.11 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.096 1.758 . . . . 0.0 111.83 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.53 0.192 0 CA-C-N 120.435 1.47 . . . . 0.0 111.413 -166.896 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 m -45.39 -61.55 1.63 Allowed 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.876 2.47 . . . . 0.0 114.542 -168.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -58.52 -26.94 64.03 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -170.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 p -96.16 -4.68 42.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 114.066 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.8 148.45 41.24 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 120.979 1.718 . . . . 0.0 112.237 -171.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -88.02 33.48 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 123.263 2.642 . . . . 0.0 112.514 -174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.3 pp -143.6 15.8 1.8 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.322 1.049 . . . . 0.0 110.463 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 t -155.81 -9.68 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 170.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.72 14.95 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.125 -1.609 . . . . 0.0 113.887 -175.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -48.34 -32.45 7.48 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.126 1.37 . . . . 0.0 114.041 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -163.27 35.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.453 1.101 . . . . 0.0 110.408 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.8 t . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 128.006 2.523 . . . . 0.0 113.458 174.107 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.781 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.13 -21.17 1.87 Allowed 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.747 0.819 . . . . 0.0 111.781 154.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -58.71 -50.26 74.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.126 0.875 . . . . 0.0 111.591 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 p -88.11 -51.08 5.99 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.945 0.498 . . . . 0.0 111.2 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -66.39 107.62 1.74 Allowed Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 124.716 1.206 . . . . 0.0 108.836 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.75 176.78 7.74 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.479 2.786 . . . . 0.0 113.889 -158.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.8 mt 80.6 -16.45 0.65 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.539 3.536 . . . . 0.0 111.428 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.73 17.25 10.28 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.973 1.309 . . . . 0.0 111.283 167.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.22 -42.52 77.37 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.686 0.794 . . . . 0.0 111.369 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -21.39 20.42 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -75.92 -9.3 58.49 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 120.859 -1.15 . . . . 0.0 111.669 175.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 124.149 0.98 . . . . 0.0 110.603 176.619 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -44.85 89.42 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 124.226 1.011 . . . . 0.0 111.733 -177.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.7 m -65.66 -20.83 66.45 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 112.672 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 p -96.63 -28.52 14.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.062 -0.97 . . . . 0.0 113.313 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.69 122.46 86.6 Favored Pre-proline 0 N--CA 1.451 -0.39 0 CA-C-N 120.757 1.617 . . . . 0.0 107.634 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.25 31.59 0.42 Allowed 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.708 2.939 . . . . 0.0 113.667 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.6 pp -143.19 10.47 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.66 1.584 . . . . 0.0 109.964 170.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -125.84 -16.37 5.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.087 1.755 . . . . 0.0 111.675 158.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.68 65.92 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.156 1.382 . . . . 0.0 112.211 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -55.7 -28.24 54.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -163.85 69.88 0.2 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.147 0.979 . . . . 0.0 109.132 -175.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.1 p . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 160.075 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.441 ' C ' ' H ' ' A' ' 4' ' ' SER . 0.8 OUTLIER -59.12 -22.72 61.31 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 126.319 1.848 . . . . 0.0 115.307 -168.304 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -66.4 13.5 0.05 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.395 1.452 . . . . 0.0 113.421 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 2' ' ' CYS . 18.8 p -96.18 -69.95 0.73 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.593 1.557 . . . . 0.0 109.627 175.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -72.51 127.61 89.76 Favored Pre-proline 0 N--CA 1.452 -0.35 0 C-N-CA 123.657 0.783 . . . . 0.0 110.093 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -66.42 -10.53 28.01 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.615 2.21 . . . . 0.0 113.452 -173.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.0 -20.35 61.03 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 109.5 177.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.4 t -124.69 -13.88 6.89 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.7 1.2 . . . . 0.0 112.786 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.92 67.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -162.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -24.31 62.73 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 120.305 1.411 . . . . 0.0 113.14 -175.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -163.71 66.83 0.17 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -173.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.9 p -65.2 -43.69 90.78 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 118.919 -1.113 . . . . 0.0 108.076 159.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.581 0 O-C-N 120.028 -1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.935 0 N-CA-C 110.366 -1.093 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.4 t -145.7 -47.68 0.22 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.997 0.899 . . . . 0.0 110.286 159.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.7 m -52.97 -28.02 21.85 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.179 0.592 . . . . 0.0 110.91 172.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -75.54 -26.26 57.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.616 2.367 . . . . 0.0 115.961 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -111.35 117.04 50.16 Favored Pre-proline 0 N--CA 1.435 -1.202 0 CA-C-N 120.285 1.402 . . . . 0.0 108.381 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.55 3.63 1.71 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.857 2.371 . . . . 0.0 113.942 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.06 -27.66 61.02 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.567 164.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.1 p -133.77 10.3 3.96 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.187 1.358 . . . . 0.0 113.608 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.94 -57.65 8.0 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 120.267 1.394 . . . . 0.0 112.742 -176.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 p-90 -62.81 -20.94 65.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.788 1.177 . . . . 0.0 113.056 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -22.06 55.9 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.894 1.678 . . . . 0.0 110.349 177.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.7 t -75.47 60.37 1.18 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.116 2.166 . . . . 0.0 107.562 169.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.595 0 O-C-N 120.242 -1.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.649 -0.58 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -8.08 5.93 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.829 2.052 . . . . 0.0 113.588 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.8 m -66.21 -18.14 65.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.076 -1.015 . . . . 0.0 112.78 168.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.9 p -93.17 -26.32 17.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.54 1.064 . . . . 0.0 113.585 -167.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -116.56 134.83 22.84 Favored Pre-proline 0 N--CA 1.444 -0.771 0 C-N-CA 125.438 1.495 . . . . 0.0 111.579 -177.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -67.19 -0.97 5.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.519 2.813 . . . . 0.0 114.921 -171.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.25 -22.61 60.37 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 119.487 1.04 . . . . 0.0 108.938 173.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.64 -17.06 2.57 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.08 -25.9 65.76 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.701 0.801 . . . . 0.0 111.789 -170.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -44.32 -13.16 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 117.754 2.501 . . . . 0.0 117.754 162.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -163.44 18.06 0.07 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.154 2.182 . . . . 0.0 111.017 171.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.6 t 46.27 34.95 2.4 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.261 1.824 . . . . 0.0 112.262 -163.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.561 0 O-C-N 119.341 -2.099 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.617 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -46.79 51.2 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 117.677 0.738 . . . . 0.0 112.003 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.8 t -66.21 -18.76 65.55 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.7 p -95.7 -47.25 6.27 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.016 1.28 . . . . 0.0 110.75 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.68 143.35 98.56 Favored Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.461 0.704 . . . . 0.0 110.583 -173.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -78.19 -11.96 16.01 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 121.034 1.156 . . . . 0.0 112.075 -166.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.83 4.1 52.65 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.611 0.764 . . . . 0.0 111.338 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -147.79 -1.52 0.59 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -32.75 72.17 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.071 -1.018 . . . . 0.0 112.16 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -59.23 -35.19 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.296 -0.878 . . . . 0.0 112.874 170.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -48.16 21.23 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 126.325 1.85 . . . . 0.0 109.898 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.7 m 39.51 52.84 2.37 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 126.567 1.947 . . . . 0.0 110.302 -160.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.602 0 O-C-N 120.899 -1.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.726 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -20.6 60.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -161.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 m -66.48 -14.86 62.83 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.433 1.47 . . . . 0.0 113.269 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.4 p -83.96 -61.9 1.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.013 0.824 . . . . 0.0 110.565 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -72.16 122.76 88.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.545 1.938 . . . . 0.0 110.227 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.71 169.71 13.99 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.253 1.969 . . . . 0.0 110.84 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.8 mt 77.78 -16.91 0.61 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.608 2.763 . . . . 0.0 111.597 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.2 t -116.32 -23.2 8.46 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.1 0.96 . . . . 0.0 112.18 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.34 -19.34 64.65 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -169.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -54.52 -32.93 59.06 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.254 1.022 . . . . 0.0 112.332 -176.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.07 84.21 0.44 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 104.519 -2.4 . . . . 0.0 104.519 172.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.05 29.0 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.565 0 O-C-N 119.966 -1.708 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.4 m -34.04 -51.77 0.43 Allowed 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.309 2.644 . . . . 0.0 115.718 -160.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.6 m -52.38 -30.51 29.34 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -173.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -79.77 -21.6 44.2 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.085 -177.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.57 144.86 31.43 Favored Pre-proline 0 N--CA 1.449 -0.513 0 CA-C-N 120.718 1.599 . . . . 0.0 112.113 -167.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.92 -3.55 14.08 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.772 2.315 . . . . 0.0 113.789 -170.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -96.0 -1.27 49.31 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.078 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -154.05 20.88 0.51 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.026 1.285 . . . . 0.0 113.365 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 30.92 0.07 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.478 1.911 . . . . 0.0 112.519 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.6 p-90 -60.94 3.41 0.09 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.393 2.277 . . . . 0.0 115.454 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 26.3 ttm105 73.48 62.7 0.09 Allowed 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 p -67.31 -3.45 8.11 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.103 1.361 . . . . 0.0 113.257 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 O-C-N 119.542 -1.974 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.747 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 -52.47 0.13 Allowed 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 163.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -66.61 7.13 0.37 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 167.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.4 p -87.15 -119.79 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.182 2.593 . . . . 0.0 108.793 -175.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -48.06 152.09 1.54 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 129.048 2.939 . . . . 0.0 111.728 165.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.25 172.86 14.73 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.995 2.463 . . . . 0.0 111.301 -171.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt 85.61 -13.89 0.59 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 129.368 3.067 . . . . 0.0 111.374 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 t -127.97 -6.15 5.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.681 0.792 . . . . 0.0 111.779 159.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.45 96.58 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.032 -1.043 . . . . 0.0 111.398 -172.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -65.94 -23.79 66.68 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -69.37 -50.94 41.56 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.6 t 46.66 -81.15 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.484 2.714 . . . . 0.0 109.681 -165.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.729 0 O-C-N 120.066 -1.646 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.827 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -46.2 -36.67 6.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.637 1.575 . . . . 0.0 114.176 -170.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -3.81 6.4 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -96.34 -12.77 23.93 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.733 1.606 . . . . 0.0 114.803 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -112.65 140.06 23.47 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 121.321 1.873 . . . . 0.0 111.115 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -70.96 -8.58 23.93 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.002 2.468 . . . . 0.0 112.842 -173.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.9 -19.22 60.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.167 0.587 . . . . 0.0 109.968 174.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -135.4 -30.02 1.04 Allowed 'General case' 0 C--N 1.341 0.201 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -169.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.36 -11.78 60.1 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -164.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.8 p-90 -58.54 -9.31 1.58 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.862 1.665 . . . . 0.0 115.028 -170.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.33 30.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.848 2.459 . . . . 0.0 108.716 174.043 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m 46.72 -56.11 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 130.161 3.384 . . . . 0.0 113.549 -158.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.753 0 O-C-N 119.668 -1.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.677 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -28.61 68.77 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -152.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.7 t -66.25 -36.91 84.24 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.89 1.223 . . . . 0.0 111.506 172.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 p -96.47 -16.99 20.86 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -167.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -114.41 146.58 36.16 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 120.275 1.398 . . . . 0.0 109.942 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.07 167.09 27.72 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 C-N-CA 121.695 1.597 . . . . 0.0 112.413 -159.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 mt 89.74 -44.5 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 131.433 3.893 . . . . 0.0 105.885 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -87.94 -23.85 23.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.814 1.646 . . . . 0.0 112.224 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.56 -40.29 68.59 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 125.33 1.452 . . . . 0.0 112.925 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.9 p-90 -55.72 -34.64 65.31 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.631 0.651 . . . . 0.0 112.038 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.2 ttt-85 -76.8 -38.39 54.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -172.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.4 m 40.84 50.39 3.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.087 1.355 . . . . 0.0 111.471 -172.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.578 0 O-C-N 120.425 -1.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.59 -13.85 62.26 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.9 m -66.1 -24.31 66.67 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.95 1.25 . . . . 0.0 111.759 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.3 p -81.56 -61.02 2.05 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 118.926 0.785 . . . . 0.0 112.312 -165.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -97.82 136.11 21.28 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 122.951 0.5 . . . . 0.0 111.687 -159.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -64.53 137.4 54.74 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.049 1.833 . . . . 0.0 108.312 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.1 mt 96.0 -2.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 1 C-N-CA 131.992 4.117 . . . . 0.0 111.536 -163.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -136.34 -27.03 1.09 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.348 1.431 . . . . 0.0 113.578 158.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -8.17 18.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 126.045 1.738 . . . . 0.0 114.837 -171.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -50.43 -34.01 23.0 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 125.467 1.507 . . . . 0.0 113.167 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.49 32.01 0.09 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.429 1.892 . . . . 0.0 109.01 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t 73.3 42.53 0.42 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.969 0.908 . . . . 0.0 109.791 169.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 120.762 -1.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 -10.7 1.33 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.009 0.923 . . . . 0.0 111.5 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.5 -12.95 60.04 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 119.706 -1.872 . . . . 0.0 113.416 159.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 p -73.86 -41.05 62.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.464 1.506 . . . . 0.0 113.351 178.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.53 154.01 49.04 Favored Pre-proline 0 C--N 1.325 -0.457 0 C-N-CA 127.417 2.287 . . . . 0.0 110.338 -168.502 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -73.63 176.32 9.51 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.629 1.553 . . . . 0.0 110.668 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt 75.33 -9.18 1.44 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.491 2.316 . . . . 0.0 111.234 173.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.3 p -129.19 -24.82 2.81 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.267 1.827 . . . . 0.0 113.167 169.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -28.48 53.13 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.739 1.216 . . . . 0.0 113.977 -172.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -46.55 -26.54 0.9 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -163.28 50.34 0.15 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.223 1.409 . . . . 0.0 108.159 169.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 m 44.26 28.94 0.32 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.155 2.982 . . . . 0.0 114.614 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.33 6.85 1.93 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.9 m -66.35 -29.17 69.31 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.038 -1.664 . . . . 0.0 111.055 158.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -82.87 -42.82 17.31 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 125.725 1.61 . . . . 0.0 113.729 -159.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.36 153.41 48.74 Favored Pre-proline 0 N--CA 1.45 -0.441 0 C-N-CA 125.92 1.688 . . . . 0.0 110.57 -169.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.35 170.22 13.9 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.673 2.248 . . . . 0.0 112.461 -168.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.53 -14.93 0.52 Allowed 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 129.786 3.234 . . . . 0.0 112.909 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -130.36 -19.61 3.08 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 177.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.78 -35.03 42.37 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.062 1.345 . . . . 0.0 111.231 176.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.0 p-90 -52.53 -15.4 0.67 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.01 1.724 . . . . 0.0 115.45 176.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -163.17 34.2 0.09 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.283 1.033 . . . . 0.0 110.694 -178.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.8 m 46.44 32.26 1.54 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.317 1.447 . . . . 0.0 113.824 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 120.112 -1.617 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.678 0 N-CA-C 109.086 -1.605 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -17.76 64.89 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -153.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.3 m -66.66 -29.96 70.1 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.698 1.135 . . . . 0.0 111.595 172.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.3 p -96.43 -63.87 1.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.245 1.418 . . . . 0.0 111.477 -172.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.09 139.29 97.64 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 178.23 7.24 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.991 2.461 . . . . 0.0 113.486 -158.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.06 4.63 4.91 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 127.01 2.124 . . . . 0.0 113.287 166.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.0 p -135.83 -5.79 2.17 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 169.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.83 -33.95 72.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 125.439 1.496 . . . . 0.0 113.231 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -56.35 -17.45 7.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.81 52.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.6 p -65.9 100.79 0.59 Allowed 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.908 0 O-C-N 120.711 -1.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.742 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 m -54.23 -27.26 33.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -173.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -29.83 60.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.021 1.282 . . . . 0.0 112.672 -178.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.5 p -92.14 -10.43 38.88 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.47 105.57 51.94 Favored Pre-proline 0 N--CA 1.441 -0.889 0 CA-C-N 120.933 1.697 . . . . 0.0 111.208 -174.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.3 145.01 98.86 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.27 1.98 . . . . 0.0 109.672 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt 96.96 -40.28 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 1 C-N-CA 133.363 4.665 . . . . 0.0 107.301 -158.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 t -105.07 -15.5 15.07 Favored 'General case' 0 N--CA 1.46 0.046 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.35 -49.3 76.6 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.388 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -26.15 68.54 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 177.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -28.37 58.22 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.074 0.95 . . . . 0.0 110.008 -178.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.97 -64.2 0.95 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 161.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 O-C-N 120.382 -1.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.621 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -63.5 -17.35 62.66 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -158.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.6 m -63.18 -19.85 64.87 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.125 1.33 . . . . 0.0 111.143 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -78.59 -53.1 7.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 118.936 0.789 . . . . 0.0 111.028 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -104.95 148.97 37.01 Favored Pre-proline 0 N--CA 1.451 -0.408 0 C-N-CA 124.115 0.966 . . . . 0.0 111.846 -159.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 8' ' ' CYS . 77.4 Cg_endo -74.88 166.2 29.76 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.016 1.81 . . . . 0.0 111.431 -165.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.3 mt 74.44 -22.26 0.26 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.239 3.015 . . . . 0.0 110.64 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.484 ' H ' ' C ' ' A' ' 6' ' ' PRO . 2.7 t -113.37 -16.98 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.662 1.585 . . . . 0.0 112.302 -175.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.84 -51.3 67.99 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 124.484 1.113 . . . . 0.0 112.012 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -22.7 66.81 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 118.754 0.706 . . . . 0.0 112.888 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 ttp-105 -76.84 -30.95 56.55 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.493 0.588 . . . . 0.0 111.746 174.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.3 t -76.37 -44.51 36.06 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 118.614 0.643 . . . . 0.0 109.492 173.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.545 0 O-C-N 121.535 -0.728 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.22 -35.45 0.24 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.292 1.037 . . . . 0.0 109.493 147.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.5 m -65.84 -37.35 85.98 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.35 -0.844 . . . . 0.0 111.405 176.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -74.16 -71.53 0.33 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 127.049 2.14 . . . . 0.0 110.629 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.99 120.5 58.12 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 124.651 1.181 . . . . 0.0 110.608 -174.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -63.08 157.37 49.54 Favored 'Trans proline' 0 N--CA 1.448 -1.158 0 C-N-CA 121.884 1.722 . . . . 0.0 109.494 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 56.1 mt 89.91 -21.93 0.12 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 131.379 3.871 . . . . 0.0 110.444 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 t -113.26 -8.08 13.52 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.157 0.89 . . . . 0.0 112.733 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.38 87.15 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.521 -0.737 . . . . 0.0 111.627 -175.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -62.18 -29.18 70.18 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 174.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -76.55 -32.52 58.24 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 124.591 1.156 . . . . 0.0 112.006 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.2 t -74.57 -34.69 62.97 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 168.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.554 0 O-C-N 120.486 -1.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.732 0 CA-C-O 119.025 -0.875 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.18 -51.16 46.14 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.118 0.967 . . . . 0.0 112.823 -168.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.1 m -56.54 -27.91 58.75 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -96.31 -17.81 20.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.92 132.64 21.81 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 120.724 1.602 . . . . 0.0 110.405 -168.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -59.48 129.38 30.89 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.93 2.42 . . . . 0.0 110.851 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.0 mt 93.51 -16.23 0.12 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 131.682 3.993 . . . . 0.0 111.39 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -110.42 -12.62 14.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.963 1.71 . . . . 0.0 112.931 165.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.64 79.91 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.685 -0.635 . . . . 0.0 110.26 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.2 p-90 -60.73 -19.95 60.05 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -76.1 -4.74 43.11 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.096 1.758 . . . . 0.0 111.83 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.82 -32.64 74.22 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 120.435 1.47 . . . . 0.0 111.413 -166.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.579 0 O-C-N 121.338 -0.851 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 m -45.39 -61.55 1.63 Allowed 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.876 2.47 . . . . 0.0 114.542 -168.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -58.52 -26.94 64.03 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -170.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 p -96.16 -4.68 42.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 114.066 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.8 148.45 41.24 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 120.979 1.718 . . . . 0.0 112.237 -171.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -88.02 33.48 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 123.263 2.642 . . . . 0.0 112.514 -174.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.3 pp -143.6 15.8 1.8 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.322 1.049 . . . . 0.0 110.463 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.6 t -155.81 -9.68 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 170.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.72 14.95 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.125 -1.609 . . . . 0.0 113.887 -175.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -48.34 -32.45 7.48 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.126 1.37 . . . . 0.0 114.041 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -163.27 35.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.453 1.101 . . . . 0.0 110.408 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.8 t 74.04 -35.6 0.31 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.006 2.523 . . . . 0.0 113.458 174.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.668 0 O-C-N 120.304 -1.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.781 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.13 -21.17 1.87 Allowed 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.747 0.819 . . . . 0.0 111.781 154.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -58.71 -50.26 74.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.126 0.875 . . . . 0.0 111.591 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 p -88.11 -51.08 5.99 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.945 0.498 . . . . 0.0 111.2 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -66.39 107.62 1.74 Allowed Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 124.716 1.206 . . . . 0.0 108.836 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.75 176.78 7.74 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.479 2.786 . . . . 0.0 113.889 -158.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.8 mt 80.6 -16.45 0.65 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.539 3.536 . . . . 0.0 111.428 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.73 17.25 10.28 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.973 1.309 . . . . 0.0 111.283 167.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.22 -42.52 77.37 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.686 0.794 . . . . 0.0 111.369 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -21.39 20.42 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -75.92 -9.3 58.49 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 120.859 -1.15 . . . . 0.0 111.669 175.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -64.52 -23.34 67.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.149 0.98 . . . . 0.0 110.603 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 O-C-N 120.459 -1.401 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -44.85 89.42 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 124.226 1.011 . . . . 0.0 111.733 -177.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.7 m -65.66 -20.83 66.45 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 112.672 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 p -96.63 -28.52 14.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.062 -0.97 . . . . 0.0 113.313 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.69 122.46 86.6 Favored Pre-proline 0 N--CA 1.451 -0.39 0 CA-C-N 120.757 1.617 . . . . 0.0 107.634 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.25 31.59 0.42 Allowed 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.708 2.939 . . . . 0.0 113.667 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.6 pp -143.19 10.47 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.66 1.584 . . . . 0.0 109.964 170.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -125.84 -16.37 5.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.087 1.755 . . . . 0.0 111.675 158.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.68 65.92 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.156 1.382 . . . . 0.0 112.211 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -55.7 -28.24 54.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -163.85 69.88 0.2 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.147 0.979 . . . . 0.0 109.132 -175.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.1 p -75.66 -173.26 2.13 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 160.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.727 0 O-C-N 120.052 -1.655 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -22.72 61.31 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 126.319 1.848 . . . . 0.0 115.307 -168.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -66.4 13.5 0.05 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.395 1.452 . . . . 0.0 113.421 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.8 p -96.18 -69.95 0.73 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.593 1.557 . . . . 0.0 109.627 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -72.51 127.61 89.76 Favored Pre-proline 0 N--CA 1.452 -0.35 0 C-N-CA 123.657 0.783 . . . . 0.0 110.093 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -66.42 -10.53 28.01 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.615 2.21 . . . . 0.0 113.452 -173.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.0 -20.35 61.03 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 109.5 177.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.4 t -124.69 -13.88 6.89 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.7 1.2 . . . . 0.0 112.786 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.92 67.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -162.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -24.31 62.73 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 120.305 1.411 . . . . 0.0 113.14 -175.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -163.71 66.83 0.17 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -173.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 CA--C 1.531 0.224 0 C-N-CA 118.919 -1.113 . . . . 0.0 108.076 159.783 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.935 0 N-CA-C 110.366 -1.093 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.4 t -145.7 -47.68 0.22 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.997 0.899 . . . . 0.0 110.286 159.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.7 m -52.97 -28.02 21.85 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.179 0.592 . . . . 0.0 110.91 172.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -75.54 -26.26 57.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.616 2.367 . . . . 0.0 115.961 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -111.35 117.04 50.16 Favored Pre-proline 0 N--CA 1.435 -1.202 0 CA-C-N 120.285 1.402 . . . . 0.0 108.381 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.55 3.63 1.71 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.857 2.371 . . . . 0.0 113.942 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.06 -27.66 61.02 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.567 164.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.1 p -133.77 10.3 3.96 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.187 1.358 . . . . 0.0 113.608 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.94 -57.65 8.0 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 120.267 1.394 . . . . 0.0 112.742 -176.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 p-90 -62.81 -20.94 65.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.788 1.177 . . . . 0.0 113.056 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -22.06 55.9 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.894 1.678 . . . . 0.0 110.349 177.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.7 t . . . . . 0 CA--C 1.535 0.391 0 C-N-CA 127.116 2.166 . . . . 0.0 107.562 169.606 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.649 -0.58 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -8.08 5.93 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.829 2.052 . . . . 0.0 113.588 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.8 m -66.21 -18.14 65.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.076 -1.015 . . . . 0.0 112.78 168.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.9 p -93.17 -26.32 17.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.54 1.064 . . . . 0.0 113.585 -167.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -116.56 134.83 22.84 Favored Pre-proline 0 N--CA 1.444 -0.771 0 C-N-CA 125.438 1.495 . . . . 0.0 111.579 -177.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -67.19 -0.97 5.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.519 2.813 . . . . 0.0 114.921 -171.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.25 -22.61 60.37 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 119.487 1.04 . . . . 0.0 108.938 173.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.64 -17.06 2.57 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.08 -25.9 65.76 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.701 0.801 . . . . 0.0 111.789 -170.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -44.32 -13.16 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 117.754 2.501 . . . . 0.0 117.754 162.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -163.44 18.06 0.07 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.154 2.182 . . . . 0.0 111.017 171.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.544 0.748 0 C-N-CA 126.261 1.824 . . . . 0.0 112.262 -163.068 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.617 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -46.79 51.2 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 117.677 0.738 . . . . 0.0 112.003 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.8 t -66.21 -18.76 65.55 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.7 p -95.7 -47.25 6.27 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.016 1.28 . . . . 0.0 110.75 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.68 143.35 98.56 Favored Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.461 0.704 . . . . 0.0 110.583 -173.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -78.19 -11.96 16.01 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 121.034 1.156 . . . . 0.0 112.075 -166.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.83 4.1 52.65 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.611 0.764 . . . . 0.0 111.338 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -147.79 -1.52 0.59 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -32.75 72.17 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.071 -1.018 . . . . 0.0 112.16 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -59.23 -35.19 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.296 -0.878 . . . . 0.0 112.874 170.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -48.16 21.23 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 126.325 1.85 . . . . 0.0 109.898 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.7 m . . . . . 0 C--O 1.226 -0.173 0 C-N-CA 126.567 1.947 . . . . 0.0 110.302 -160.126 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.726 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -20.6 60.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -161.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 m -66.48 -14.86 62.83 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.433 1.47 . . . . 0.0 113.269 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.4 p -83.96 -61.9 1.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.013 0.824 . . . . 0.0 110.565 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -72.16 122.76 88.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.545 1.938 . . . . 0.0 110.227 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.71 169.71 13.99 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.253 1.969 . . . . 0.0 110.84 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.8 mt 77.78 -16.91 0.61 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.608 2.763 . . . . 0.0 111.597 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.2 t -116.32 -23.2 8.46 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.1 0.96 . . . . 0.0 112.18 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.34 -19.34 64.65 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -169.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -54.52 -32.93 59.06 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.254 1.022 . . . . 0.0 112.332 -176.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.07 84.21 0.44 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 104.519 -2.4 . . . . 0.0 104.519 172.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -174.977 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.4 m -34.04 -51.77 0.43 Allowed 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.309 2.644 . . . . 0.0 115.718 -160.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.6 m -52.38 -30.51 29.34 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -173.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -79.77 -21.6 44.2 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.085 -177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.57 144.86 31.43 Favored Pre-proline 0 N--CA 1.449 -0.513 0 CA-C-N 120.718 1.599 . . . . 0.0 112.113 -167.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.92 -3.55 14.08 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.772 2.315 . . . . 0.0 113.789 -170.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -96.0 -1.27 49.31 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.078 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -154.05 20.88 0.51 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.026 1.285 . . . . 0.0 113.365 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 30.92 0.07 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.478 1.911 . . . . 0.0 112.519 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.6 p-90 -60.94 3.41 0.09 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.393 2.277 . . . . 0.0 115.454 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 26.3 ttm105 73.48 62.7 0.09 Allowed 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 p . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 125.103 1.361 . . . . 0.0 113.257 -175.786 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.747 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 -52.47 0.13 Allowed 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 163.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -66.61 7.13 0.37 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 167.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.4 p -87.15 -119.79 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.182 2.593 . . . . 0.0 108.793 -175.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -48.06 152.09 1.54 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 129.048 2.939 . . . . 0.0 111.728 165.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.25 172.86 14.73 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.995 2.463 . . . . 0.0 111.301 -171.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt 85.61 -13.89 0.59 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 129.368 3.067 . . . . 0.0 111.374 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 t -127.97 -6.15 5.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.681 0.792 . . . . 0.0 111.779 159.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.45 96.58 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.032 -1.043 . . . . 0.0 111.398 -172.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -65.94 -23.79 66.68 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -69.37 -50.94 41.56 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.447 -0.607 0 C-N-CA 128.484 2.714 . . . . 0.0 109.681 -165.224 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.827 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -46.2 -36.67 6.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.637 1.575 . . . . 0.0 114.176 -170.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -3.81 6.4 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -96.34 -12.77 23.93 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.733 1.606 . . . . 0.0 114.803 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -112.65 140.06 23.47 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 121.321 1.873 . . . . 0.0 111.115 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -70.96 -8.58 23.93 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.002 2.468 . . . . 0.0 112.842 -173.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.9 -19.22 60.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.167 0.587 . . . . 0.0 109.968 174.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -135.4 -30.02 1.04 Allowed 'General case' 0 C--N 1.341 0.201 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -169.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.36 -11.78 60.1 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -164.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.8 p-90 -58.54 -9.31 1.58 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.862 1.665 . . . . 0.0 115.028 -170.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.33 30.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.848 2.459 . . . . 0.0 108.716 174.043 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 C--O 1.221 -0.397 0 C-N-CA 130.161 3.384 . . . . 0.0 113.549 -158.554 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.677 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -28.61 68.77 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -152.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.7 t -66.25 -36.91 84.24 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.89 1.223 . . . . 0.0 111.506 172.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 p -96.47 -16.99 20.86 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -167.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -114.41 146.58 36.16 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 120.275 1.398 . . . . 0.0 109.942 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.07 167.09 27.72 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 C-N-CA 121.695 1.597 . . . . 0.0 112.413 -159.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 mt 89.74 -44.5 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 131.433 3.893 . . . . 0.0 105.885 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -87.94 -23.85 23.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.814 1.646 . . . . 0.0 112.224 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.56 -40.29 68.59 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 125.33 1.452 . . . . 0.0 112.925 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.9 p-90 -55.72 -34.64 65.31 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.631 0.651 . . . . 0.0 112.038 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.2 ttt-85 -76.8 -38.39 54.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -172.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.537 0.452 0 C-N-CA 125.087 1.355 . . . . 0.0 111.471 -172.061 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.59 -13.85 62.26 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.9 m -66.1 -24.31 66.67 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.95 1.25 . . . . 0.0 111.759 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.3 p -81.56 -61.02 2.05 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 118.926 0.785 . . . . 0.0 112.312 -165.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -97.82 136.11 21.28 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 122.951 0.5 . . . . 0.0 111.687 -159.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -64.53 137.4 54.74 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.049 1.833 . . . . 0.0 108.312 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.1 mt 96.0 -2.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 1 C-N-CA 131.992 4.117 . . . . 0.0 111.536 -163.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -136.34 -27.03 1.09 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.348 1.431 . . . . 0.0 113.578 158.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -8.17 18.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 126.045 1.738 . . . . 0.0 114.837 -171.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -50.43 -34.01 23.0 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 125.467 1.507 . . . . 0.0 113.167 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.49 32.01 0.09 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.429 1.892 . . . . 0.0 109.01 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t . . . . . 0 CA--C 1.533 0.302 0 C-N-CA 123.969 0.908 . . . . 0.0 109.791 169.449 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 -10.7 1.33 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.009 0.923 . . . . 0.0 111.5 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.5 -12.95 60.04 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 119.706 -1.872 . . . . 0.0 113.416 159.465 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 p -73.86 -41.05 62.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.464 1.506 . . . . 0.0 113.351 178.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.53 154.01 49.04 Favored Pre-proline 0 C--N 1.325 -0.457 0 C-N-CA 127.417 2.287 . . . . 0.0 110.338 -168.502 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -73.63 176.32 9.51 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.629 1.553 . . . . 0.0 110.668 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt 75.33 -9.18 1.44 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.491 2.316 . . . . 0.0 111.234 173.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.3 p -129.19 -24.82 2.81 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.267 1.827 . . . . 0.0 113.167 169.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -28.48 53.13 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.739 1.216 . . . . 0.0 113.977 -172.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -46.55 -26.54 0.9 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -163.28 50.34 0.15 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.223 1.409 . . . . 0.0 108.159 169.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 m . . . . . 0 CA--C 1.536 0.423 0 C-N-CA 129.155 2.982 . . . . 0.0 114.614 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.33 6.85 1.93 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.9 m -66.35 -29.17 69.31 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.038 -1.664 . . . . 0.0 111.055 158.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -82.87 -42.82 17.31 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 125.725 1.61 . . . . 0.0 113.729 -159.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.36 153.41 48.74 Favored Pre-proline 0 N--CA 1.45 -0.441 0 C-N-CA 125.92 1.688 . . . . 0.0 110.57 -169.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.35 170.22 13.9 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.673 2.248 . . . . 0.0 112.461 -168.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.53 -14.93 0.52 Allowed 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 129.786 3.234 . . . . 0.0 112.909 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -130.36 -19.61 3.08 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 177.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.78 -35.03 42.37 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.062 1.345 . . . . 0.0 111.231 176.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.0 p-90 -52.53 -15.4 0.67 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.01 1.724 . . . . 0.0 115.45 176.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -163.17 34.2 0.09 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.283 1.033 . . . . 0.0 110.694 -178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 125.317 1.447 . . . . 0.0 113.824 -177.9 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.678 0 N-CA-C 109.086 -1.605 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -17.76 64.89 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -153.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.3 m -66.66 -29.96 70.1 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.698 1.135 . . . . 0.0 111.595 172.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.3 p -96.43 -63.87 1.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.245 1.418 . . . . 0.0 111.477 -172.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.09 139.29 97.64 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 178.23 7.24 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.991 2.461 . . . . 0.0 113.486 -158.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.06 4.63 4.91 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 127.01 2.124 . . . . 0.0 113.287 166.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.0 p -135.83 -5.79 2.17 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 169.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.83 -33.95 72.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 125.439 1.496 . . . . 0.0 113.231 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -56.35 -17.45 7.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.81 52.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.444 -0.772 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.673 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.742 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 m -54.23 -27.26 33.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -173.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -29.83 60.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.021 1.282 . . . . 0.0 112.672 -178.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.5 p -92.14 -10.43 38.88 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.47 105.57 51.94 Favored Pre-proline 0 N--CA 1.441 -0.889 0 CA-C-N 120.933 1.697 . . . . 0.0 111.208 -174.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.3 145.01 98.86 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.27 1.98 . . . . 0.0 109.672 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt 96.96 -40.28 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 1 C-N-CA 133.363 4.665 . . . . 0.0 107.301 -158.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 t -105.07 -15.5 15.07 Favored 'General case' 0 N--CA 1.46 0.046 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.35 -49.3 76.6 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.388 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -26.15 68.54 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 177.236 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -28.37 58.22 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.074 0.95 . . . . 0.0 110.008 -178.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 161.221 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.621 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -63.5 -17.35 62.66 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -158.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.6 m -63.18 -19.85 64.87 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.125 1.33 . . . . 0.0 111.143 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -78.59 -53.1 7.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 118.936 0.789 . . . . 0.0 111.028 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -104.95 148.97 37.01 Favored Pre-proline 0 N--CA 1.451 -0.408 0 C-N-CA 124.115 0.966 . . . . 0.0 111.846 -159.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -74.88 166.2 29.76 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.016 1.81 . . . . 0.0 111.431 -165.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.3 mt 74.44 -22.26 0.26 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.239 3.015 . . . . 0.0 110.64 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -113.37 -16.98 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.662 1.585 . . . . 0.0 112.302 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.84 -51.3 67.99 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 124.484 1.113 . . . . 0.0 112.012 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -22.7 66.81 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 118.754 0.706 . . . . 0.0 112.888 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 ttp-105 -76.84 -30.95 56.55 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.493 0.588 . . . . 0.0 111.746 174.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 N--CA 1.447 -0.594 0 CA-C-N 118.614 0.643 . . . . 0.0 109.492 173.608 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.22 -35.45 0.24 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.292 1.037 . . . . 0.0 109.493 147.379 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.5 m -65.84 -37.35 85.98 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.35 -0.844 . . . . 0.0 111.405 176.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -74.16 -71.53 0.33 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 127.049 2.14 . . . . 0.0 110.629 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.99 120.5 58.12 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 124.651 1.181 . . . . 0.0 110.608 -174.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -63.08 157.37 49.54 Favored 'Trans proline' 0 N--CA 1.448 -1.158 0 C-N-CA 121.884 1.722 . . . . 0.0 109.494 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 56.1 mt 89.91 -21.93 0.12 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 131.379 3.871 . . . . 0.0 110.444 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 t -113.26 -8.08 13.52 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.157 0.89 . . . . 0.0 112.733 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.38 87.15 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.521 -0.737 . . . . 0.0 111.627 -175.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -62.18 -29.18 70.18 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 174.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -76.55 -32.52 58.24 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 124.591 1.156 . . . . 0.0 112.006 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.2 t . . . . . 0 CA--C 1.535 0.372 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 168.449 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.732 0 CA-C-O 119.025 -0.875 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.18 -51.16 46.14 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.118 0.967 . . . . 0.0 112.823 -168.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.1 m -56.54 -27.91 58.75 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -96.31 -17.81 20.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.92 132.64 21.81 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 120.724 1.602 . . . . 0.0 110.405 -168.081 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -59.48 129.38 30.89 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.93 2.42 . . . . 0.0 110.851 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.0 mt 93.51 -16.23 0.12 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 131.682 3.993 . . . . 0.0 111.39 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -110.42 -12.62 14.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.963 1.71 . . . . 0.0 112.931 165.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.64 79.91 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.685 -0.635 . . . . 0.0 110.26 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.2 p-90 -60.73 -19.95 60.05 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -76.1 -4.74 43.11 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.096 1.758 . . . . 0.0 111.83 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.53 0.192 0 CA-C-N 120.435 1.47 . . . . 0.0 111.413 -166.896 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 8' ' ' CYS . 1.6 m -45.39 -61.55 1.63 Allowed 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.876 2.47 . . . . 0.0 114.542 -168.321 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -58.52 -26.94 64.03 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -170.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 p -96.16 -4.68 42.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 114.066 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.8 148.45 41.24 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 120.979 1.718 . . . . 0.0 112.237 -171.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -88.02 33.48 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 123.263 2.642 . . . . 0.0 112.514 -174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.3 pp -143.6 15.8 1.8 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.322 1.049 . . . . 0.0 110.463 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' CYS . 31.6 t -155.81 -9.68 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 170.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.72 14.95 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.125 -1.609 . . . . 0.0 113.887 -175.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -48.34 -32.45 7.48 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.126 1.37 . . . . 0.0 114.041 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -163.27 35.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.453 1.101 . . . . 0.0 110.408 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.8 t . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 128.006 2.523 . . . . 0.0 113.458 174.107 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.781 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.13 -21.17 1.87 Allowed 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.747 0.819 . . . . 0.0 111.781 154.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -58.71 -50.26 74.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.126 0.875 . . . . 0.0 111.591 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 p -88.11 -51.08 5.99 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.945 0.498 . . . . 0.0 111.2 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -66.39 107.62 1.74 Allowed Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 124.716 1.206 . . . . 0.0 108.836 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.75 176.78 7.74 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.479 2.786 . . . . 0.0 113.889 -158.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.8 mt 80.6 -16.45 0.65 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.539 3.536 . . . . 0.0 111.428 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.73 17.25 10.28 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.973 1.309 . . . . 0.0 111.283 167.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.22 -42.52 77.37 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.686 0.794 . . . . 0.0 111.369 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -21.39 20.42 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -75.92 -9.3 58.49 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 120.859 -1.15 . . . . 0.0 111.669 175.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 124.149 0.98 . . . . 0.0 110.603 176.619 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -44.85 89.42 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 124.226 1.011 . . . . 0.0 111.733 -177.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.7 m -65.66 -20.83 66.45 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 112.672 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 p -96.63 -28.52 14.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.062 -0.97 . . . . 0.0 113.313 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.69 122.46 86.6 Favored Pre-proline 0 N--CA 1.451 -0.39 0 CA-C-N 120.757 1.617 . . . . 0.0 107.634 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.25 31.59 0.42 Allowed 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.708 2.939 . . . . 0.0 113.667 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.6 pp -143.19 10.47 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.66 1.584 . . . . 0.0 109.964 170.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -125.84 -16.37 5.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.087 1.755 . . . . 0.0 111.675 158.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.68 65.92 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.156 1.382 . . . . 0.0 112.211 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -55.7 -28.24 54.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -163.85 69.88 0.2 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.147 0.979 . . . . 0.0 109.132 -175.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.1 p . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 160.075 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -22.72 61.31 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 126.319 1.848 . . . . 0.0 115.307 -168.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -66.4 13.5 0.05 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.395 1.452 . . . . 0.0 113.421 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.8 p -96.18 -69.95 0.73 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.593 1.557 . . . . 0.0 109.627 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -72.51 127.61 89.76 Favored Pre-proline 0 N--CA 1.452 -0.35 0 C-N-CA 123.657 0.783 . . . . 0.0 110.093 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -66.42 -10.53 28.01 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.615 2.21 . . . . 0.0 113.452 -173.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.0 -20.35 61.03 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 109.5 177.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.4 t -124.69 -13.88 6.89 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.7 1.2 . . . . 0.0 112.786 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.92 67.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -162.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -24.31 62.73 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 120.305 1.411 . . . . 0.0 113.14 -175.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -163.71 66.83 0.17 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -173.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.9 p -65.2 -43.69 90.78 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 118.919 -1.113 . . . . 0.0 108.076 159.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.581 0 O-C-N 120.028 -1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.935 0 N-CA-C 110.366 -1.093 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.4 t -145.7 -47.68 0.22 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.997 0.899 . . . . 0.0 110.286 159.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.7 m -52.97 -28.02 21.85 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.179 0.592 . . . . 0.0 110.91 172.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -75.54 -26.26 57.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.616 2.367 . . . . 0.0 115.961 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -111.35 117.04 50.16 Favored Pre-proline 0 N--CA 1.435 -1.202 0 CA-C-N 120.285 1.402 . . . . 0.0 108.381 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.55 3.63 1.71 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.857 2.371 . . . . 0.0 113.942 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.06 -27.66 61.02 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.567 164.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.1 p -133.77 10.3 3.96 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.187 1.358 . . . . 0.0 113.608 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.94 -57.65 8.0 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 120.267 1.394 . . . . 0.0 112.742 -176.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 p-90 -62.81 -20.94 65.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.788 1.177 . . . . 0.0 113.056 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -22.06 55.9 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.894 1.678 . . . . 0.0 110.349 177.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.7 t -75.47 60.37 1.18 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.116 2.166 . . . . 0.0 107.562 169.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.595 0 O-C-N 120.242 -1.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.649 -0.58 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -8.08 5.93 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.829 2.052 . . . . 0.0 113.588 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.8 m -66.21 -18.14 65.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.076 -1.015 . . . . 0.0 112.78 168.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.9 p -93.17 -26.32 17.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.54 1.064 . . . . 0.0 113.585 -167.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -116.56 134.83 22.84 Favored Pre-proline 0 N--CA 1.444 -0.771 0 C-N-CA 125.438 1.495 . . . . 0.0 111.579 -177.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -67.19 -0.97 5.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.519 2.813 . . . . 0.0 114.921 -171.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.25 -22.61 60.37 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 119.487 1.04 . . . . 0.0 108.938 173.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.64 -17.06 2.57 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.08 -25.9 65.76 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.701 0.801 . . . . 0.0 111.789 -170.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -44.32 -13.16 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 117.754 2.501 . . . . 0.0 117.754 162.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -163.44 18.06 0.07 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.154 2.182 . . . . 0.0 111.017 171.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.6 t 46.27 34.95 2.4 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.261 1.824 . . . . 0.0 112.262 -163.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.561 0 O-C-N 119.341 -2.099 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.617 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -46.79 51.2 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 117.677 0.738 . . . . 0.0 112.003 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.8 t -66.21 -18.76 65.55 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.7 p -95.7 -47.25 6.27 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.016 1.28 . . . . 0.0 110.75 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.68 143.35 98.56 Favored Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.461 0.704 . . . . 0.0 110.583 -173.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -78.19 -11.96 16.01 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 121.034 1.156 . . . . 0.0 112.075 -166.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.83 4.1 52.65 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.611 0.764 . . . . 0.0 111.338 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -147.79 -1.52 0.59 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -32.75 72.17 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.071 -1.018 . . . . 0.0 112.16 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -59.23 -35.19 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.296 -0.878 . . . . 0.0 112.874 170.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -48.16 21.23 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 126.325 1.85 . . . . 0.0 109.898 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.7 m 39.51 52.84 2.37 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 126.567 1.947 . . . . 0.0 110.302 -160.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.602 0 O-C-N 120.899 -1.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.726 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -20.6 60.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -161.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 m -66.48 -14.86 62.83 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.433 1.47 . . . . 0.0 113.269 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.4 p -83.96 -61.9 1.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.013 0.824 . . . . 0.0 110.565 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -72.16 122.76 88.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.545 1.938 . . . . 0.0 110.227 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.71 169.71 13.99 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.253 1.969 . . . . 0.0 110.84 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.8 mt 77.78 -16.91 0.61 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.608 2.763 . . . . 0.0 111.597 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.2 t -116.32 -23.2 8.46 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.1 0.96 . . . . 0.0 112.18 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.34 -19.34 64.65 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -169.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -54.52 -32.93 59.06 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.254 1.022 . . . . 0.0 112.332 -176.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.07 84.21 0.44 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 104.519 -2.4 . . . . 0.0 104.519 172.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.05 29.0 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.565 0 O-C-N 119.966 -1.708 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.4 m -34.04 -51.77 0.43 Allowed 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.309 2.644 . . . . 0.0 115.718 -160.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.6 m -52.38 -30.51 29.34 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -173.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -79.77 -21.6 44.2 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.085 -177.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.57 144.86 31.43 Favored Pre-proline 0 N--CA 1.449 -0.513 0 CA-C-N 120.718 1.599 . . . . 0.0 112.113 -167.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.92 -3.55 14.08 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.772 2.315 . . . . 0.0 113.789 -170.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -96.0 -1.27 49.31 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.078 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -154.05 20.88 0.51 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.026 1.285 . . . . 0.0 113.365 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 30.92 0.07 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.478 1.911 . . . . 0.0 112.519 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.6 p-90 -60.94 3.41 0.09 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.393 2.277 . . . . 0.0 115.454 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 26.3 ttm105 73.48 62.7 0.09 Allowed 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 p -67.31 -3.45 8.11 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.103 1.361 . . . . 0.0 113.257 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 O-C-N 119.542 -1.974 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.747 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 -52.47 0.13 Allowed 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 163.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -66.61 7.13 0.37 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 167.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.4 p -87.15 -119.79 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.182 2.593 . . . . 0.0 108.793 -175.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -48.06 152.09 1.54 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 129.048 2.939 . . . . 0.0 111.728 165.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.25 172.86 14.73 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.995 2.463 . . . . 0.0 111.301 -171.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt 85.61 -13.89 0.59 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 129.368 3.067 . . . . 0.0 111.374 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 t -127.97 -6.15 5.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.681 0.792 . . . . 0.0 111.779 159.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.45 96.58 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.032 -1.043 . . . . 0.0 111.398 -172.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -65.94 -23.79 66.68 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -69.37 -50.94 41.56 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.6 t 46.66 -81.15 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.484 2.714 . . . . 0.0 109.681 -165.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.729 0 O-C-N 120.066 -1.646 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.827 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -46.2 -36.67 6.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.637 1.575 . . . . 0.0 114.176 -170.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -3.81 6.4 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -96.34 -12.77 23.93 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.733 1.606 . . . . 0.0 114.803 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -112.65 140.06 23.47 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 121.321 1.873 . . . . 0.0 111.115 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -70.96 -8.58 23.93 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.002 2.468 . . . . 0.0 112.842 -173.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.9 -19.22 60.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.167 0.587 . . . . 0.0 109.968 174.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -135.4 -30.02 1.04 Allowed 'General case' 0 C--N 1.341 0.201 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -169.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.36 -11.78 60.1 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -164.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.8 p-90 -58.54 -9.31 1.58 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.862 1.665 . . . . 0.0 115.028 -170.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.33 30.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.848 2.459 . . . . 0.0 108.716 174.043 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m 46.72 -56.11 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 130.161 3.384 . . . . 0.0 113.549 -158.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.753 0 O-C-N 119.668 -1.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.677 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -28.61 68.77 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -152.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.7 t -66.25 -36.91 84.24 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.89 1.223 . . . . 0.0 111.506 172.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 p -96.47 -16.99 20.86 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -167.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -114.41 146.58 36.16 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 120.275 1.398 . . . . 0.0 109.942 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.07 167.09 27.72 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 C-N-CA 121.695 1.597 . . . . 0.0 112.413 -159.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 mt 89.74 -44.5 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 131.433 3.893 . . . . 0.0 105.885 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -87.94 -23.85 23.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.814 1.646 . . . . 0.0 112.224 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.56 -40.29 68.59 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 125.33 1.452 . . . . 0.0 112.925 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.9 p-90 -55.72 -34.64 65.31 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.631 0.651 . . . . 0.0 112.038 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.2 ttt-85 -76.8 -38.39 54.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -172.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.4 m 40.84 50.39 3.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.087 1.355 . . . . 0.0 111.471 -172.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.578 0 O-C-N 120.425 -1.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.59 -13.85 62.26 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.9 m -66.1 -24.31 66.67 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.95 1.25 . . . . 0.0 111.759 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.3 p -81.56 -61.02 2.05 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 118.926 0.785 . . . . 0.0 112.312 -165.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -97.82 136.11 21.28 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 122.951 0.5 . . . . 0.0 111.687 -159.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -64.53 137.4 54.74 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.049 1.833 . . . . 0.0 108.312 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.1 mt 96.0 -2.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 1 C-N-CA 131.992 4.117 . . . . 0.0 111.536 -163.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -136.34 -27.03 1.09 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.348 1.431 . . . . 0.0 113.578 158.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -8.17 18.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 126.045 1.738 . . . . 0.0 114.837 -171.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -50.43 -34.01 23.0 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 125.467 1.507 . . . . 0.0 113.167 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.49 32.01 0.09 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.429 1.892 . . . . 0.0 109.01 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t 73.3 42.53 0.42 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.969 0.908 . . . . 0.0 109.791 169.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 120.762 -1.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 -10.7 1.33 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.009 0.923 . . . . 0.0 111.5 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.5 -12.95 60.04 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 119.706 -1.872 . . . . 0.0 113.416 159.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 p -73.86 -41.05 62.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.464 1.506 . . . . 0.0 113.351 178.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.53 154.01 49.04 Favored Pre-proline 0 C--N 1.325 -0.457 0 C-N-CA 127.417 2.287 . . . . 0.0 110.338 -168.502 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -73.63 176.32 9.51 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.629 1.553 . . . . 0.0 110.668 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt 75.33 -9.18 1.44 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.491 2.316 . . . . 0.0 111.234 173.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.3 p -129.19 -24.82 2.81 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.267 1.827 . . . . 0.0 113.167 169.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -28.48 53.13 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.739 1.216 . . . . 0.0 113.977 -172.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -46.55 -26.54 0.9 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -163.28 50.34 0.15 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.223 1.409 . . . . 0.0 108.159 169.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 m 44.26 28.94 0.32 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.155 2.982 . . . . 0.0 114.614 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.33 6.85 1.93 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.9 m -66.35 -29.17 69.31 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.038 -1.664 . . . . 0.0 111.055 158.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -82.87 -42.82 17.31 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 125.725 1.61 . . . . 0.0 113.729 -159.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.36 153.41 48.74 Favored Pre-proline 0 N--CA 1.45 -0.441 0 C-N-CA 125.92 1.688 . . . . 0.0 110.57 -169.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.35 170.22 13.9 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.673 2.248 . . . . 0.0 112.461 -168.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.53 -14.93 0.52 Allowed 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 129.786 3.234 . . . . 0.0 112.909 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -130.36 -19.61 3.08 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 177.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.78 -35.03 42.37 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.062 1.345 . . . . 0.0 111.231 176.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.0 p-90 -52.53 -15.4 0.67 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.01 1.724 . . . . 0.0 115.45 176.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -163.17 34.2 0.09 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.283 1.033 . . . . 0.0 110.694 -178.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.8 m 46.44 32.26 1.54 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.317 1.447 . . . . 0.0 113.824 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 120.112 -1.617 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.678 0 N-CA-C 109.086 -1.605 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -17.76 64.89 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -153.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.3 m -66.66 -29.96 70.1 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.698 1.135 . . . . 0.0 111.595 172.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.3 p -96.43 -63.87 1.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.245 1.418 . . . . 0.0 111.477 -172.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.09 139.29 97.64 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 178.23 7.24 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.991 2.461 . . . . 0.0 113.486 -158.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.06 4.63 4.91 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 127.01 2.124 . . . . 0.0 113.287 166.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.0 p -135.83 -5.79 2.17 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 169.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.83 -33.95 72.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 125.439 1.496 . . . . 0.0 113.231 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -56.35 -17.45 7.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.81 52.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.6 p -65.9 100.79 0.59 Allowed 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.908 0 O-C-N 120.711 -1.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.742 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 m -54.23 -27.26 33.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -173.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -29.83 60.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.021 1.282 . . . . 0.0 112.672 -178.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.5 p -92.14 -10.43 38.88 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.47 105.57 51.94 Favored Pre-proline 0 N--CA 1.441 -0.889 0 CA-C-N 120.933 1.697 . . . . 0.0 111.208 -174.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.3 145.01 98.86 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.27 1.98 . . . . 0.0 109.672 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt 96.96 -40.28 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 1 C-N-CA 133.363 4.665 . . . . 0.0 107.301 -158.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 t -105.07 -15.5 15.07 Favored 'General case' 0 N--CA 1.46 0.046 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.35 -49.3 76.6 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.388 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -26.15 68.54 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 177.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -28.37 58.22 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.074 0.95 . . . . 0.0 110.008 -178.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.97 -64.2 0.95 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 161.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 O-C-N 120.382 -1.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.621 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -63.5 -17.35 62.66 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -158.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.6 m -63.18 -19.85 64.87 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.125 1.33 . . . . 0.0 111.143 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -78.59 -53.1 7.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 118.936 0.789 . . . . 0.0 111.028 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -104.95 148.97 37.01 Favored Pre-proline 0 N--CA 1.451 -0.408 0 C-N-CA 124.115 0.966 . . . . 0.0 111.846 -159.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -74.88 166.2 29.76 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.016 1.81 . . . . 0.0 111.431 -165.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.3 mt 74.44 -22.26 0.26 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.239 3.015 . . . . 0.0 110.64 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -113.37 -16.98 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.662 1.585 . . . . 0.0 112.302 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.84 -51.3 67.99 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 124.484 1.113 . . . . 0.0 112.012 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -22.7 66.81 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 118.754 0.706 . . . . 0.0 112.888 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 ttp-105 -76.84 -30.95 56.55 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.493 0.588 . . . . 0.0 111.746 174.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.3 t -76.37 -44.51 36.06 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 118.614 0.643 . . . . 0.0 109.492 173.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.545 0 O-C-N 121.535 -0.728 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.22 -35.45 0.24 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.292 1.037 . . . . 0.0 109.493 147.379 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.5 m -65.84 -37.35 85.98 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.35 -0.844 . . . . 0.0 111.405 176.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -74.16 -71.53 0.33 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 127.049 2.14 . . . . 0.0 110.629 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.99 120.5 58.12 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 124.651 1.181 . . . . 0.0 110.608 -174.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -63.08 157.37 49.54 Favored 'Trans proline' 0 N--CA 1.448 -1.158 0 C-N-CA 121.884 1.722 . . . . 0.0 109.494 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 56.1 mt 89.91 -21.93 0.12 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 131.379 3.871 . . . . 0.0 110.444 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 t -113.26 -8.08 13.52 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.157 0.89 . . . . 0.0 112.733 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.38 87.15 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.521 -0.737 . . . . 0.0 111.627 -175.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -62.18 -29.18 70.18 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 174.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -76.55 -32.52 58.24 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 124.591 1.156 . . . . 0.0 112.006 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.2 t -74.57 -34.69 62.97 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 168.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.554 0 O-C-N 120.486 -1.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.732 0 CA-C-O 119.025 -0.875 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.18 -51.16 46.14 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.118 0.967 . . . . 0.0 112.823 -168.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.1 m -56.54 -27.91 58.75 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -96.31 -17.81 20.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.92 132.64 21.81 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 120.724 1.602 . . . . 0.0 110.405 -168.081 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -59.48 129.38 30.89 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.93 2.42 . . . . 0.0 110.851 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.0 mt 93.51 -16.23 0.12 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 131.682 3.993 . . . . 0.0 111.39 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -110.42 -12.62 14.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.963 1.71 . . . . 0.0 112.931 165.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.64 79.91 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.685 -0.635 . . . . 0.0 110.26 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.2 p-90 -60.73 -19.95 60.05 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -76.1 -4.74 43.11 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.096 1.758 . . . . 0.0 111.83 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.82 -32.64 74.22 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 120.435 1.47 . . . . 0.0 111.413 -166.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.579 0 O-C-N 121.338 -0.851 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 8' ' ' CYS . 1.6 m -45.39 -61.55 1.63 Allowed 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.876 2.47 . . . . 0.0 114.542 -168.321 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -58.52 -26.94 64.03 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -170.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 p -96.16 -4.68 42.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 114.066 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.8 148.45 41.24 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 120.979 1.718 . . . . 0.0 112.237 -171.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -88.02 33.48 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 123.263 2.642 . . . . 0.0 112.514 -174.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.3 pp -143.6 15.8 1.8 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.322 1.049 . . . . 0.0 110.463 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' CYS . 31.6 t -155.81 -9.68 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 170.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.72 14.95 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.125 -1.609 . . . . 0.0 113.887 -175.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -48.34 -32.45 7.48 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.126 1.37 . . . . 0.0 114.041 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -163.27 35.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.453 1.101 . . . . 0.0 110.408 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.8 t 74.04 -35.6 0.31 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.006 2.523 . . . . 0.0 113.458 174.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.668 0 O-C-N 120.304 -1.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.781 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.13 -21.17 1.87 Allowed 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.747 0.819 . . . . 0.0 111.781 154.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -58.71 -50.26 74.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.126 0.875 . . . . 0.0 111.591 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 p -88.11 -51.08 5.99 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.945 0.498 . . . . 0.0 111.2 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -66.39 107.62 1.74 Allowed Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 124.716 1.206 . . . . 0.0 108.836 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.75 176.78 7.74 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.479 2.786 . . . . 0.0 113.889 -158.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.8 mt 80.6 -16.45 0.65 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.539 3.536 . . . . 0.0 111.428 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.73 17.25 10.28 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.973 1.309 . . . . 0.0 111.283 167.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.22 -42.52 77.37 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.686 0.794 . . . . 0.0 111.369 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -21.39 20.42 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -75.92 -9.3 58.49 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 120.859 -1.15 . . . . 0.0 111.669 175.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -64.52 -23.34 67.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.149 0.98 . . . . 0.0 110.603 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 O-C-N 120.459 -1.401 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -44.85 89.42 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 124.226 1.011 . . . . 0.0 111.733 -177.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.7 m -65.66 -20.83 66.45 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 112.672 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 p -96.63 -28.52 14.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.062 -0.97 . . . . 0.0 113.313 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.69 122.46 86.6 Favored Pre-proline 0 N--CA 1.451 -0.39 0 CA-C-N 120.757 1.617 . . . . 0.0 107.634 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.25 31.59 0.42 Allowed 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.708 2.939 . . . . 0.0 113.667 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.6 pp -143.19 10.47 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.66 1.584 . . . . 0.0 109.964 170.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -125.84 -16.37 5.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.087 1.755 . . . . 0.0 111.675 158.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.68 65.92 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.156 1.382 . . . . 0.0 112.211 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -55.7 -28.24 54.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -163.85 69.88 0.2 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.147 0.979 . . . . 0.0 109.132 -175.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.1 p -75.66 -173.26 2.13 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 160.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.727 0 O-C-N 120.052 -1.655 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -22.72 61.31 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 126.319 1.848 . . . . 0.0 115.307 -168.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -66.4 13.5 0.05 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.395 1.452 . . . . 0.0 113.421 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.8 p -96.18 -69.95 0.73 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.593 1.557 . . . . 0.0 109.627 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -72.51 127.61 89.76 Favored Pre-proline 0 N--CA 1.452 -0.35 0 C-N-CA 123.657 0.783 . . . . 0.0 110.093 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -66.42 -10.53 28.01 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.615 2.21 . . . . 0.0 113.452 -173.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.0 -20.35 61.03 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 109.5 177.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.4 t -124.69 -13.88 6.89 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.7 1.2 . . . . 0.0 112.786 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.92 67.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -162.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -24.31 62.73 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 120.305 1.411 . . . . 0.0 113.14 -175.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -163.71 66.83 0.17 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -173.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.9 p . . . . . 0 CA--C 1.531 0.224 0 C-N-CA 118.919 -1.113 . . . . 0.0 108.076 159.783 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.935 0 N-CA-C 110.366 -1.093 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.4 t -145.7 -47.68 0.22 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.997 0.899 . . . . 0.0 110.286 159.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.7 m -52.97 -28.02 21.85 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.179 0.592 . . . . 0.0 110.91 172.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -75.54 -26.26 57.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.616 2.367 . . . . 0.0 115.961 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -111.35 117.04 50.16 Favored Pre-proline 0 N--CA 1.435 -1.202 0 CA-C-N 120.285 1.402 . . . . 0.0 108.381 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.55 3.63 1.71 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.857 2.371 . . . . 0.0 113.942 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.06 -27.66 61.02 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.567 164.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.1 p -133.77 10.3 3.96 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.187 1.358 . . . . 0.0 113.608 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.94 -57.65 8.0 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 120.267 1.394 . . . . 0.0 112.742 -176.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 p-90 -62.81 -20.94 65.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.788 1.177 . . . . 0.0 113.056 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -22.06 55.9 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.894 1.678 . . . . 0.0 110.349 177.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.7 t . . . . . 0 CA--C 1.535 0.391 0 C-N-CA 127.116 2.166 . . . . 0.0 107.562 169.606 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.649 -0.58 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -8.08 5.93 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.829 2.052 . . . . 0.0 113.588 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.8 m -66.21 -18.14 65.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.076 -1.015 . . . . 0.0 112.78 168.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.9 p -93.17 -26.32 17.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.54 1.064 . . . . 0.0 113.585 -167.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -116.56 134.83 22.84 Favored Pre-proline 0 N--CA 1.444 -0.771 0 C-N-CA 125.438 1.495 . . . . 0.0 111.579 -177.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -67.19 -0.97 5.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.519 2.813 . . . . 0.0 114.921 -171.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.25 -22.61 60.37 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 119.487 1.04 . . . . 0.0 108.938 173.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.64 -17.06 2.57 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.08 -25.9 65.76 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.701 0.801 . . . . 0.0 111.789 -170.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -44.32 -13.16 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 117.754 2.501 . . . . 0.0 117.754 162.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -163.44 18.06 0.07 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.154 2.182 . . . . 0.0 111.017 171.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.544 0.748 0 C-N-CA 126.261 1.824 . . . . 0.0 112.262 -163.068 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.617 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -46.79 51.2 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 117.677 0.738 . . . . 0.0 112.003 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.8 t -66.21 -18.76 65.55 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.7 p -95.7 -47.25 6.27 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.016 1.28 . . . . 0.0 110.75 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.68 143.35 98.56 Favored Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.461 0.704 . . . . 0.0 110.583 -173.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -78.19 -11.96 16.01 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 121.034 1.156 . . . . 0.0 112.075 -166.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.83 4.1 52.65 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.611 0.764 . . . . 0.0 111.338 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -147.79 -1.52 0.59 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -32.75 72.17 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.071 -1.018 . . . . 0.0 112.16 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -59.23 -35.19 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.296 -0.878 . . . . 0.0 112.874 170.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -48.16 21.23 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 126.325 1.85 . . . . 0.0 109.898 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.7 m . . . . . 0 C--O 1.226 -0.173 0 C-N-CA 126.567 1.947 . . . . 0.0 110.302 -160.126 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.726 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -20.6 60.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -161.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 m -66.48 -14.86 62.83 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.433 1.47 . . . . 0.0 113.269 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.4 p -83.96 -61.9 1.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.013 0.824 . . . . 0.0 110.565 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -72.16 122.76 88.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.545 1.938 . . . . 0.0 110.227 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.71 169.71 13.99 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.253 1.969 . . . . 0.0 110.84 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.8 mt 77.78 -16.91 0.61 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.608 2.763 . . . . 0.0 111.597 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.2 t -116.32 -23.2 8.46 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.1 0.96 . . . . 0.0 112.18 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.34 -19.34 64.65 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -169.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -54.52 -32.93 59.06 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.254 1.022 . . . . 0.0 112.332 -176.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.07 84.21 0.44 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 104.519 -2.4 . . . . 0.0 104.519 172.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.54 0.56 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -174.977 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.4 m -34.04 -51.77 0.43 Allowed 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.309 2.644 . . . . 0.0 115.718 -160.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.6 m -52.38 -30.51 29.34 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -173.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -79.77 -21.6 44.2 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.085 -177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.57 144.86 31.43 Favored Pre-proline 0 N--CA 1.449 -0.513 0 CA-C-N 120.718 1.599 . . . . 0.0 112.113 -167.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.92 -3.55 14.08 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.772 2.315 . . . . 0.0 113.789 -170.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -96.0 -1.27 49.31 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.078 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -154.05 20.88 0.51 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.026 1.285 . . . . 0.0 113.365 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 30.92 0.07 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.478 1.911 . . . . 0.0 112.519 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.6 p-90 -60.94 3.41 0.09 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.393 2.277 . . . . 0.0 115.454 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 26.3 ttm105 73.48 62.7 0.09 Allowed 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 p . . . . . 0 CA--C 1.538 0.494 0 C-N-CA 125.103 1.361 . . . . 0.0 113.257 -175.786 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.747 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 -52.47 0.13 Allowed 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 163.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -66.61 7.13 0.37 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 167.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.4 p -87.15 -119.79 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.182 2.593 . . . . 0.0 108.793 -175.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -48.06 152.09 1.54 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 129.048 2.939 . . . . 0.0 111.728 165.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.25 172.86 14.73 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.995 2.463 . . . . 0.0 111.301 -171.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt 85.61 -13.89 0.59 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 129.368 3.067 . . . . 0.0 111.374 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 t -127.97 -6.15 5.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.681 0.792 . . . . 0.0 111.779 159.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.45 96.58 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.032 -1.043 . . . . 0.0 111.398 -172.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -65.94 -23.79 66.68 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -69.37 -50.94 41.56 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.447 -0.607 0 C-N-CA 128.484 2.714 . . . . 0.0 109.681 -165.224 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.827 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -46.2 -36.67 6.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.637 1.575 . . . . 0.0 114.176 -170.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -3.81 6.4 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -96.34 -12.77 23.93 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.733 1.606 . . . . 0.0 114.803 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -112.65 140.06 23.47 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 121.321 1.873 . . . . 0.0 111.115 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -70.96 -8.58 23.93 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.002 2.468 . . . . 0.0 112.842 -173.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.9 -19.22 60.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.167 0.587 . . . . 0.0 109.968 174.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -135.4 -30.02 1.04 Allowed 'General case' 0 C--N 1.341 0.201 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -169.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.36 -11.78 60.1 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -164.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.8 p-90 -58.54 -9.31 1.58 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.862 1.665 . . . . 0.0 115.028 -170.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.33 30.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.848 2.459 . . . . 0.0 108.716 174.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 C--O 1.221 -0.397 0 C-N-CA 130.161 3.384 . . . . 0.0 113.549 -158.554 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.677 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -28.61 68.77 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -152.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.7 t -66.25 -36.91 84.24 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.89 1.223 . . . . 0.0 111.506 172.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 p -96.47 -16.99 20.86 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -167.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -114.41 146.58 36.16 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 120.275 1.398 . . . . 0.0 109.942 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.07 167.09 27.72 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 C-N-CA 121.695 1.597 . . . . 0.0 112.413 -159.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 mt 89.74 -44.5 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 131.433 3.893 . . . . 0.0 105.885 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -87.94 -23.85 23.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.814 1.646 . . . . 0.0 112.224 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.56 -40.29 68.59 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 125.33 1.452 . . . . 0.0 112.925 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.9 p-90 -55.72 -34.64 65.31 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.631 0.651 . . . . 0.0 112.038 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.2 ttt-85 -76.8 -38.39 54.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -172.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.537 0.452 0 C-N-CA 125.087 1.355 . . . . 0.0 111.471 -172.061 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.59 -13.85 62.26 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.9 m -66.1 -24.31 66.67 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.95 1.25 . . . . 0.0 111.759 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.3 p -81.56 -61.02 2.05 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 118.926 0.785 . . . . 0.0 112.312 -165.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -97.82 136.11 21.28 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 122.951 0.5 . . . . 0.0 111.687 -159.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -64.53 137.4 54.74 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.049 1.833 . . . . 0.0 108.312 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.1 mt 96.0 -2.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 1 C-N-CA 131.992 4.117 . . . . 0.0 111.536 -163.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -136.34 -27.03 1.09 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.348 1.431 . . . . 0.0 113.578 158.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -8.17 18.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 126.045 1.738 . . . . 0.0 114.837 -171.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -50.43 -34.01 23.0 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 125.467 1.507 . . . . 0.0 113.167 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.49 32.01 0.09 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.429 1.892 . . . . 0.0 109.01 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t . . . . . 0 CA--C 1.533 0.302 0 C-N-CA 123.969 0.908 . . . . 0.0 109.791 169.449 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 -10.7 1.33 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.009 0.923 . . . . 0.0 111.5 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.5 -12.95 60.04 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 119.706 -1.872 . . . . 0.0 113.416 159.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 p -73.86 -41.05 62.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.464 1.506 . . . . 0.0 113.351 178.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.53 154.01 49.04 Favored Pre-proline 0 C--N 1.325 -0.457 0 C-N-CA 127.417 2.287 . . . . 0.0 110.338 -168.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -73.63 176.32 9.51 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.629 1.553 . . . . 0.0 110.668 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt 75.33 -9.18 1.44 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.491 2.316 . . . . 0.0 111.234 173.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.3 p -129.19 -24.82 2.81 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.267 1.827 . . . . 0.0 113.167 169.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -28.48 53.13 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.739 1.216 . . . . 0.0 113.977 -172.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -46.55 -26.54 0.9 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -163.28 50.34 0.15 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.223 1.409 . . . . 0.0 108.159 169.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 m . . . . . 0 CA--C 1.536 0.423 0 C-N-CA 129.155 2.982 . . . . 0.0 114.614 177.906 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.33 6.85 1.93 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.9 m -66.35 -29.17 69.31 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.038 -1.664 . . . . 0.0 111.055 158.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -82.87 -42.82 17.31 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 125.725 1.61 . . . . 0.0 113.729 -159.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.36 153.41 48.74 Favored Pre-proline 0 N--CA 1.45 -0.441 0 C-N-CA 125.92 1.688 . . . . 0.0 110.57 -169.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.35 170.22 13.9 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.673 2.248 . . . . 0.0 112.461 -168.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.53 -14.93 0.52 Allowed 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 129.786 3.234 . . . . 0.0 112.909 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -130.36 -19.61 3.08 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 177.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.78 -35.03 42.37 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.062 1.345 . . . . 0.0 111.231 176.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.0 p-90 -52.53 -15.4 0.67 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.01 1.724 . . . . 0.0 115.45 176.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -163.17 34.2 0.09 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.283 1.033 . . . . 0.0 110.694 -178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 125.317 1.447 . . . . 0.0 113.824 -177.9 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.678 0 N-CA-C 109.086 -1.605 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -17.76 64.89 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -153.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.3 m -66.66 -29.96 70.1 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.698 1.135 . . . . 0.0 111.595 172.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.3 p -96.43 -63.87 1.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.245 1.418 . . . . 0.0 111.477 -172.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.09 139.29 97.64 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 178.23 7.24 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.991 2.461 . . . . 0.0 113.486 -158.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.06 4.63 4.91 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 127.01 2.124 . . . . 0.0 113.287 166.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.0 p -135.83 -5.79 2.17 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 169.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.83 -33.95 72.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 125.439 1.496 . . . . 0.0 113.231 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -56.35 -17.45 7.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.81 52.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.444 -0.772 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.673 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.742 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 m -54.23 -27.26 33.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -173.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -29.83 60.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.021 1.282 . . . . 0.0 112.672 -178.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.5 p -92.14 -10.43 38.88 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.47 105.57 51.94 Favored Pre-proline 0 N--CA 1.441 -0.889 0 CA-C-N 120.933 1.697 . . . . 0.0 111.208 -174.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.3 145.01 98.86 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.27 1.98 . . . . 0.0 109.672 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt 96.96 -40.28 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 1 C-N-CA 133.363 4.665 . . . . 0.0 107.301 -158.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 t -105.07 -15.5 15.07 Favored 'General case' 0 N--CA 1.46 0.046 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.35 -49.3 76.6 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.388 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -26.15 68.54 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 177.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -28.37 58.22 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.074 0.95 . . . . 0.0 110.008 -178.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 161.221 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.621 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -63.5 -17.35 62.66 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -158.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.6 m -63.18 -19.85 64.87 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.125 1.33 . . . . 0.0 111.143 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -78.59 -53.1 7.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 118.936 0.789 . . . . 0.0 111.028 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -104.95 148.97 37.01 Favored Pre-proline 0 N--CA 1.451 -0.408 0 C-N-CA 124.115 0.966 . . . . 0.0 111.846 -159.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -74.88 166.2 29.76 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.016 1.81 . . . . 0.0 111.431 -165.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.3 mt 74.44 -22.26 0.26 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.239 3.015 . . . . 0.0 110.64 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -113.37 -16.98 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.662 1.585 . . . . 0.0 112.302 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.84 -51.3 67.99 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 124.484 1.113 . . . . 0.0 112.012 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -22.7 66.81 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 118.754 0.706 . . . . 0.0 112.888 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 ttp-105 -76.84 -30.95 56.55 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.493 0.588 . . . . 0.0 111.746 174.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 N--CA 1.447 -0.594 0 CA-C-N 118.614 0.643 . . . . 0.0 109.492 173.608 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.22 -35.45 0.24 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.292 1.037 . . . . 0.0 109.493 147.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.5 m -65.84 -37.35 85.98 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.35 -0.844 . . . . 0.0 111.405 176.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -74.16 -71.53 0.33 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 127.049 2.14 . . . . 0.0 110.629 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.99 120.5 58.12 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 124.651 1.181 . . . . 0.0 110.608 -174.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -63.08 157.37 49.54 Favored 'Trans proline' 0 N--CA 1.448 -1.158 0 C-N-CA 121.884 1.722 . . . . 0.0 109.494 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 56.1 mt 89.91 -21.93 0.12 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 131.379 3.871 . . . . 0.0 110.444 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 t -113.26 -8.08 13.52 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.157 0.89 . . . . 0.0 112.733 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.38 87.15 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.521 -0.737 . . . . 0.0 111.627 -175.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -62.18 -29.18 70.18 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 174.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -76.55 -32.52 58.24 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 124.591 1.156 . . . . 0.0 112.006 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.2 t . . . . . 0 CA--C 1.535 0.372 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 168.449 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.732 0 CA-C-O 119.025 -0.875 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.18 -51.16 46.14 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.118 0.967 . . . . 0.0 112.823 -168.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.1 m -56.54 -27.91 58.75 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -96.31 -17.81 20.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.92 132.64 21.81 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 120.724 1.602 . . . . 0.0 110.405 -168.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -59.48 129.38 30.89 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.93 2.42 . . . . 0.0 110.851 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.0 mt 93.51 -16.23 0.12 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 131.682 3.993 . . . . 0.0 111.39 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -110.42 -12.62 14.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.963 1.71 . . . . 0.0 112.931 165.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.64 79.91 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.685 -0.635 . . . . 0.0 110.26 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.2 p-90 -60.73 -19.95 60.05 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -76.1 -4.74 43.11 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.096 1.758 . . . . 0.0 111.83 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.53 0.192 0 CA-C-N 120.435 1.47 . . . . 0.0 111.413 -166.896 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 8' ' ' CYS . 1.6 m -45.39 -61.55 1.63 Allowed 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.876 2.47 . . . . 0.0 114.542 -168.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -58.52 -26.94 64.03 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -170.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 p -96.16 -4.68 42.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 114.066 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.8 148.45 41.24 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 120.979 1.718 . . . . 0.0 112.237 -171.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -88.02 33.48 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 123.263 2.642 . . . . 0.0 112.514 -174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.3 pp -143.6 15.8 1.8 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.322 1.049 . . . . 0.0 110.463 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' CYS . 31.6 t -155.81 -9.68 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 170.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.72 14.95 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.125 -1.609 . . . . 0.0 113.887 -175.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -48.34 -32.45 7.48 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.126 1.37 . . . . 0.0 114.041 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -163.27 35.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.453 1.101 . . . . 0.0 110.408 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.8 t . . . . . 0 CA--C 1.535 0.369 0 C-N-CA 128.006 2.523 . . . . 0.0 113.458 174.107 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.781 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.13 -21.17 1.87 Allowed 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.747 0.819 . . . . 0.0 111.781 154.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -58.71 -50.26 74.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.126 0.875 . . . . 0.0 111.591 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 p -88.11 -51.08 5.99 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.945 0.498 . . . . 0.0 111.2 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -66.39 107.62 1.74 Allowed Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 124.716 1.206 . . . . 0.0 108.836 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.75 176.78 7.74 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.479 2.786 . . . . 0.0 113.889 -158.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.8 mt 80.6 -16.45 0.65 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.539 3.536 . . . . 0.0 111.428 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.73 17.25 10.28 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.973 1.309 . . . . 0.0 111.283 167.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.22 -42.52 77.37 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.686 0.794 . . . . 0.0 111.369 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -21.39 20.42 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -75.92 -9.3 58.49 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 120.859 -1.15 . . . . 0.0 111.669 175.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 124.149 0.98 . . . . 0.0 110.603 176.619 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -44.85 89.42 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 124.226 1.011 . . . . 0.0 111.733 -177.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.7 m -65.66 -20.83 66.45 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 112.672 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 p -96.63 -28.52 14.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.062 -0.97 . . . . 0.0 113.313 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.69 122.46 86.6 Favored Pre-proline 0 N--CA 1.451 -0.39 0 CA-C-N 120.757 1.617 . . . . 0.0 107.634 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.25 31.59 0.42 Allowed 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.708 2.939 . . . . 0.0 113.667 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.6 pp -143.19 10.47 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.66 1.584 . . . . 0.0 109.964 170.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -125.84 -16.37 5.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.087 1.755 . . . . 0.0 111.675 158.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.68 65.92 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.156 1.382 . . . . 0.0 112.211 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -55.7 -28.24 54.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -163.85 69.88 0.2 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.147 0.979 . . . . 0.0 109.132 -175.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.1 p . . . . . 0 N--CA 1.45 -0.461 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 160.075 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.85 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -59.12 -22.72 61.31 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 126.319 1.848 . . . . 0.0 115.307 -168.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.9 m -66.4 13.5 0.05 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.395 1.452 . . . . 0.0 113.421 175.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.8 p -96.18 -69.95 0.73 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.593 1.557 . . . . 0.0 109.627 175.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -72.51 127.61 89.76 Favored Pre-proline 0 N--CA 1.452 -0.35 0 C-N-CA 123.657 0.783 . . . . 0.0 110.093 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -66.42 -10.53 28.01 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.615 2.21 . . . . 0.0 113.452 -173.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.9 mp -73.0 -20.35 61.03 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 109.5 177.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.4 t -124.69 -13.88 6.89 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.7 1.2 . . . . 0.0 112.786 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.06 -22.92 67.04 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.221 1.563 . . . . 0.0 115.221 -162.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -24.31 62.73 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 120.305 1.411 . . . . 0.0 113.14 -175.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.0 ttp-105 -163.71 66.83 0.17 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 -173.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.9 p -65.2 -43.69 90.78 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 118.919 -1.113 . . . . 0.0 108.076 159.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.581 0 O-C-N 120.028 -1.67 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.935 0 N-CA-C 110.366 -1.093 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 48.4 t -145.7 -47.68 0.22 Allowed 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 117.997 0.899 . . . . 0.0 110.286 159.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.7 m -52.97 -28.02 21.85 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.179 0.592 . . . . 0.0 110.91 172.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -75.54 -26.26 57.87 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 127.616 2.367 . . . . 0.0 115.961 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -111.35 117.04 50.16 Favored Pre-proline 0 N--CA 1.435 -1.202 0 CA-C-N 120.285 1.402 . . . . 0.0 108.381 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -67.55 3.63 1.71 Allowed 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.857 2.371 . . . . 0.0 113.942 -176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.9 mt -74.06 -27.66 61.02 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 117.892 -1.052 . . . . 0.0 110.567 164.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.1 p -133.77 10.3 3.96 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.187 1.358 . . . . 0.0 113.608 176.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.94 -57.65 8.0 Favored 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 120.267 1.394 . . . . 0.0 112.742 -176.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 6.0 p-90 -62.81 -20.94 65.53 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.788 1.177 . . . . 0.0 113.056 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -22.06 55.9 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.894 1.678 . . . . 0.0 110.349 177.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.7 t -75.47 60.37 1.18 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.116 2.166 . . . . 0.0 107.562 169.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.595 0 O-C-N 120.242 -1.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.649 -0.58 . . . . 0.0 111.649 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.65 -8.08 5.93 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 126.829 2.052 . . . . 0.0 113.588 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 55.8 m -66.21 -18.14 65.16 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.076 -1.015 . . . . 0.0 112.78 168.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.9 p -93.17 -26.32 17.46 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.54 1.064 . . . . 0.0 113.585 -167.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -116.56 134.83 22.84 Favored Pre-proline 0 N--CA 1.444 -0.771 0 C-N-CA 125.438 1.495 . . . . 0.0 111.579 -177.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo -67.19 -0.97 5.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.519 2.813 . . . . 0.0 114.921 -171.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 61.8 mt -73.25 -22.61 60.37 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 119.487 1.04 . . . . 0.0 108.938 173.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -132.64 -17.06 2.57 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 172.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.08 -25.9 65.76 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.701 0.801 . . . . 0.0 111.789 -170.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.8 p-90 -44.32 -13.16 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 117.754 2.501 . . . . 0.0 117.754 162.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.9 ptt85 -163.44 18.06 0.07 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.154 2.182 . . . . 0.0 111.017 171.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.6 t 46.27 34.95 2.4 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.261 1.824 . . . . 0.0 112.262 -163.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.561 0 O-C-N 119.341 -2.099 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.617 0 N-CA-C 108.857 -1.697 . . . . 0.0 108.857 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -46.79 51.2 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 117.677 0.738 . . . . 0.0 112.003 -177.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.8 t -66.21 -18.76 65.55 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.7 p -95.7 -47.25 6.27 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 120.016 1.28 . . . . 0.0 110.75 178.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.68 143.35 98.56 Favored Pre-proline 0 N--CA 1.451 -0.416 0 C-N-CA 123.461 0.704 . . . . 0.0 110.583 -173.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -78.19 -11.96 16.01 Favored 'Trans proline' 0 N--CA 1.449 -1.105 0 C-N-CA 121.034 1.156 . . . . 0.0 112.075 -166.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -90.83 4.1 52.65 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 123.611 0.764 . . . . 0.0 111.338 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -147.79 -1.52 0.59 Allowed 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 178.224 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.87 -32.75 72.17 Favored 'General case' 0 CA--C 1.53 0.197 0 O-C-N 121.071 -1.018 . . . . 0.0 112.16 -177.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.7 p-90 -59.23 -35.19 73.2 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.296 -0.878 . . . . 0.0 112.874 170.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.26 -48.16 21.23 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 126.325 1.85 . . . . 0.0 109.898 -177.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.7 m 39.51 52.84 2.37 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 126.567 1.947 . . . . 0.0 110.302 -160.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.602 0 O-C-N 120.899 -1.125 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.726 0 N-CA-C 109.909 -1.276 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.39 -20.6 60.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 114.198 1.185 . . . . 0.0 114.198 -161.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.5 m -66.48 -14.86 62.83 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.433 1.47 . . . . 0.0 113.269 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 64.4 p -83.96 -61.9 1.7 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.013 0.824 . . . . 0.0 110.565 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -72.16 122.76 88.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 126.545 1.938 . . . . 0.0 110.227 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.71 169.71 13.99 Favored 'Trans proline' 0 N--CA 1.451 -1.016 0 C-N-CA 122.253 1.969 . . . . 0.0 110.84 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.8 mt 77.78 -16.91 0.61 Allowed 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 128.608 2.763 . . . . 0.0 111.597 -170.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.2 t -116.32 -23.2 8.46 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.1 0.96 . . . . 0.0 112.18 173.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.34 -19.34 64.65 Favored 'General case' 0 N--CA 1.45 -0.458 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -169.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -54.52 -32.93 59.06 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.254 1.022 . . . . 0.0 112.332 -176.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.07 84.21 0.44 Allowed 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 104.519 -2.4 . . . . 0.0 104.519 172.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.6 p -69.05 29.0 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.565 0 O-C-N 119.966 -1.708 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.601 0 N-CA-C 109.037 -1.625 . . . . 0.0 109.037 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.4 m -34.04 -51.77 0.43 Allowed 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 128.309 2.644 . . . . 0.0 115.718 -160.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.6 m -52.38 -30.51 29.34 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 114.352 1.241 . . . . 0.0 114.352 -173.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -79.77 -21.6 44.2 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 117.858 -1.068 . . . . 0.0 113.085 -177.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -111.57 144.86 31.43 Favored Pre-proline 0 N--CA 1.449 -0.513 0 CA-C-N 120.718 1.599 . . . . 0.0 112.113 -167.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -74.92 -3.55 14.08 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.772 2.315 . . . . 0.0 113.789 -170.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.6 mt -96.0 -1.27 49.31 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.078 174.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -154.05 20.88 0.51 Allowed 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 120.026 1.285 . . . . 0.0 113.365 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.72 30.92 0.07 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.478 1.911 . . . . 0.0 112.519 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 15.6 p-90 -60.94 3.41 0.09 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.393 2.277 . . . . 0.0 115.454 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 26.3 ttm105 73.48 62.7 0.09 Allowed 'General case' 0 CA--C 1.518 -0.28 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 -172.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.0 p -67.31 -3.45 8.11 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.103 1.361 . . . . 0.0 113.257 -175.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 O-C-N 119.542 -1.974 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.747 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 -52.47 0.13 Allowed 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 163.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -66.61 7.13 0.37 Allowed 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 167.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.4 p -87.15 -119.79 0.04 OUTLIER 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.182 2.593 . . . . 0.0 108.793 -175.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -48.06 152.09 1.54 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 129.048 2.939 . . . . 0.0 111.728 165.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.25 172.86 14.73 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.995 2.463 . . . . 0.0 111.301 -171.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 53.4 mt 85.61 -13.89 0.59 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 129.368 3.067 . . . . 0.0 111.374 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.4 t -127.97 -6.15 5.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.681 0.792 . . . . 0.0 111.779 159.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.45 96.58 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.032 -1.043 . . . . 0.0 111.398 -172.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.5 p-90 -65.94 -23.79 66.68 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 176.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -69.37 -50.94 41.56 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 174.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 6.6 t 46.66 -81.15 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.484 2.714 . . . . 0.0 109.681 -165.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.729 0 O-C-N 120.066 -1.646 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.827 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -46.2 -36.67 6.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.637 1.575 . . . . 0.0 114.176 -170.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.19 -3.81 6.4 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.448 1.647 . . . . 0.0 115.448 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.1 p -96.34 -12.77 23.93 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.733 1.606 . . . . 0.0 114.803 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -112.65 140.06 23.47 Favored Pre-proline 0 N--CA 1.451 -0.418 0 CA-C-N 121.321 1.873 . . . . 0.0 111.115 -177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -70.96 -8.58 23.93 Favored 'Trans proline' 0 N--CA 1.458 -0.58 0 C-N-CA 123.002 2.468 . . . . 0.0 112.842 -173.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 22.7 mt -73.9 -19.22 60.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.167 0.587 . . . . 0.0 109.968 174.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -135.4 -30.02 1.04 Allowed 'General case' 0 C--N 1.341 0.201 0 N-CA-C 113.966 1.099 . . . . 0.0 113.966 -169.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.36 -11.78 60.1 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 115.218 1.562 . . . . 0.0 115.218 -164.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 2.8 p-90 -58.54 -9.31 1.58 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.862 1.665 . . . . 0.0 115.028 -170.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.33 30.25 0.09 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 127.848 2.459 . . . . 0.0 108.716 174.043 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.5 m 46.72 -56.11 0.0 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 130.161 3.384 . . . . 0.0 113.549 -158.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.753 0 O-C-N 119.668 -1.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.677 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -28.61 68.77 Favored 'General case' 0 C--O 1.224 -0.248 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -152.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.7 t -66.25 -36.91 84.24 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.89 1.223 . . . . 0.0 111.506 172.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.0 p -96.47 -16.99 20.86 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 115.824 1.787 . . . . 0.0 115.824 -167.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -114.41 146.58 36.16 Favored Pre-proline 0 N--CA 1.443 -0.781 0 CA-C-N 120.275 1.398 . . . . 0.0 109.942 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.07 167.09 27.72 Favored 'Trans proline' 0 N--CA 1.451 -1.008 0 C-N-CA 121.695 1.597 . . . . 0.0 112.413 -159.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 mt 89.74 -44.5 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 131.433 3.893 . . . . 0.0 105.885 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.6 t -87.94 -23.85 23.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.814 1.646 . . . . 0.0 112.224 176.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.56 -40.29 68.59 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 125.33 1.452 . . . . 0.0 112.925 -167.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.9 p-90 -55.72 -34.64 65.31 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.631 0.651 . . . . 0.0 112.038 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 46.2 ttt-85 -76.8 -38.39 54.04 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -172.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 69.4 m 40.84 50.39 3.02 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.087 1.355 . . . . 0.0 111.471 -172.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.578 0 O-C-N 120.425 -1.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.59 -13.85 62.26 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 10.9 m -66.1 -24.31 66.67 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.95 1.25 . . . . 0.0 111.759 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 88.3 p -81.56 -61.02 2.05 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 118.926 0.785 . . . . 0.0 112.312 -165.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -97.82 136.11 21.28 Favored Pre-proline 0 N--CA 1.45 -0.472 0 C-N-CA 122.951 0.5 . . . . 0.0 111.687 -159.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -64.53 137.4 54.74 Favored 'Trans proline' 0 N--CA 1.45 -1.08 0 C-N-CA 122.049 1.833 . . . . 0.0 108.312 177.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.1 mt 96.0 -2.17 0.06 Allowed 'General case' 0 C--N 1.327 -0.39 1 C-N-CA 131.992 4.117 . . . . 0.0 111.536 -163.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -136.34 -27.03 1.09 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 120.348 1.431 . . . . 0.0 113.578 158.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.57 -8.17 18.56 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 126.045 1.738 . . . . 0.0 114.837 -171.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 3.9 p-90 -50.43 -34.01 23.0 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 125.467 1.507 . . . . 0.0 113.167 -176.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.49 32.01 0.09 Allowed 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.429 1.892 . . . . 0.0 109.01 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 t 73.3 42.53 0.42 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.969 0.908 . . . . 0.0 109.791 169.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 O-C-N 120.762 -1.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.601 -1.0 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.84 -10.7 1.33 Allowed 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 124.009 0.923 . . . . 0.0 111.5 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.5 -12.95 60.04 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 119.706 -1.872 . . . . 0.0 113.416 159.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.3 p -73.86 -41.05 62.77 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.464 1.506 . . . . 0.0 113.351 178.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -116.53 154.01 49.04 Favored Pre-proline 0 C--N 1.325 -0.457 0 C-N-CA 127.417 2.287 . . . . 0.0 110.338 -168.502 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -73.63 176.32 9.51 Favored 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 121.629 1.553 . . . . 0.0 110.668 -173.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt 75.33 -9.18 1.44 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 127.491 2.316 . . . . 0.0 111.234 173.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.3 p -129.19 -24.82 2.81 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.267 1.827 . . . . 0.0 113.167 169.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.15 -28.48 53.13 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 124.739 1.216 . . . . 0.0 113.977 -172.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.3 p-90 -46.55 -26.54 0.9 Allowed 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 178.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -163.28 50.34 0.15 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.223 1.409 . . . . 0.0 108.159 169.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.7 m 44.26 28.94 0.32 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 129.155 2.982 . . . . 0.0 114.614 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.645 0 O-C-N 120.228 -1.545 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.921 0 N-CA-C 110.832 -0.907 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.33 6.85 1.93 Allowed 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 57.9 m -66.35 -29.17 69.31 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.038 -1.664 . . . . 0.0 111.055 158.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -82.87 -42.82 17.31 Favored 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 125.725 1.61 . . . . 0.0 113.729 -159.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -116.36 153.41 48.74 Favored Pre-proline 0 N--CA 1.45 -0.441 0 C-N-CA 125.92 1.688 . . . . 0.0 110.57 -169.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -67.35 170.22 13.9 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 122.673 2.248 . . . . 0.0 112.461 -168.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mt 72.53 -14.93 0.52 Allowed 'General case' 0 CA--C 1.519 -0.244 0 C-N-CA 129.786 3.234 . . . . 0.0 112.909 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -130.36 -19.61 3.08 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.55 0.945 . . . . 0.0 113.55 177.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.78 -35.03 42.37 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.062 1.345 . . . . 0.0 111.231 176.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 5.0 p-90 -52.53 -15.4 0.67 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.01 1.724 . . . . 0.0 115.45 176.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.1 tpt180 -163.17 34.2 0.09 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.283 1.033 . . . . 0.0 110.694 -178.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 18.8 m 46.44 32.26 1.54 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.317 1.447 . . . . 0.0 113.824 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.662 0 O-C-N 120.112 -1.617 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.678 0 N-CA-C 109.086 -1.605 . . . . 0.0 109.086 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -17.76 64.89 Favored 'General case' 0 C--O 1.223 -0.312 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -153.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.3 m -66.66 -29.96 70.1 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.698 1.135 . . . . 0.0 111.595 172.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 86.3 p -96.43 -63.87 1.1 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.245 1.418 . . . . 0.0 111.477 -172.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.09 139.29 97.64 Favored Pre-proline 0 CA--C 1.537 0.451 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 174.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -74.23 178.23 7.24 Favored 'Trans proline' 0 N--CA 1.458 -0.588 0 C-N-CA 122.991 2.461 . . . . 0.0 113.486 -158.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 70.06 4.63 4.91 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 127.01 2.124 . . . . 0.0 113.287 166.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.0 p -135.83 -5.79 2.17 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.621 1.168 . . . . 0.0 113.17 169.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.83 -33.95 72.44 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 125.439 1.496 . . . . 0.0 113.231 -173.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -56.35 -17.45 7.88 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 115.396 1.628 . . . . 0.0 115.396 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.81 52.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 8.6 p -65.9 100.79 0.59 Allowed 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 177.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.315 -0.908 0 O-C-N 120.711 -1.243 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.742 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 m -54.23 -27.26 33.42 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 114.997 1.481 . . . . 0.0 114.997 -173.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -55.71 -29.83 60.12 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.021 1.282 . . . . 0.0 112.672 -178.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.5 p -92.14 -10.43 38.88 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 -176.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.47 105.57 51.94 Favored Pre-proline 0 N--CA 1.441 -0.889 0 CA-C-N 120.933 1.697 . . . . 0.0 111.208 -174.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.3 145.01 98.86 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.27 1.98 . . . . 0.0 109.672 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt 96.96 -40.28 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 1 C-N-CA 133.363 4.665 . . . . 0.0 107.301 -158.483 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.6 t -105.07 -15.5 15.07 Favored 'General case' 0 N--CA 1.46 0.046 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 176.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.35 -49.3 76.6 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.388 -179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -26.15 68.54 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 177.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.84 -28.37 58.22 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 124.074 0.95 . . . . 0.0 110.008 -178.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 7.0 t -63.97 -64.2 0.95 Allowed 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 105.596 -2.002 . . . . 0.0 105.596 161.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 O-C-N 120.382 -1.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.621 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 m -63.5 -17.35 62.66 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -158.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.6 m -63.18 -19.85 64.87 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.125 1.33 . . . . 0.0 111.143 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -78.59 -53.1 7.55 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 118.936 0.789 . . . . 0.0 111.028 178.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -104.95 148.97 37.01 Favored Pre-proline 0 N--CA 1.451 -0.408 0 C-N-CA 124.115 0.966 . . . . 0.0 111.846 -159.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -74.88 166.2 29.76 Favored 'Trans proline' 0 N--CA 1.45 -1.037 0 C-N-CA 122.016 1.81 . . . . 0.0 111.431 -165.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.3 mt 74.44 -22.26 0.26 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 129.239 3.015 . . . . 0.0 110.64 -174.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 2.7 t -113.37 -16.98 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.662 1.585 . . . . 0.0 112.302 -175.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.84 -51.3 67.99 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 124.484 1.113 . . . . 0.0 112.012 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -65.41 -22.7 66.81 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 118.754 0.706 . . . . 0.0 112.888 178.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.2 ttp-105 -76.84 -30.95 56.55 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 118.493 0.588 . . . . 0.0 111.746 174.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 53.3 t -76.37 -44.51 36.06 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 118.614 0.643 . . . . 0.0 109.492 173.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.545 0 O-C-N 121.535 -0.728 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.908 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.22 -35.45 0.24 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 124.292 1.037 . . . . 0.0 109.493 147.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.5 m -65.84 -37.35 85.98 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 121.35 -0.844 . . . . 0.0 111.405 176.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.0 p -74.16 -71.53 0.33 Allowed 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 127.049 2.14 . . . . 0.0 110.629 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -61.99 120.5 58.12 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 124.651 1.181 . . . . 0.0 110.608 -174.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -63.08 157.37 49.54 Favored 'Trans proline' 0 N--CA 1.448 -1.158 0 C-N-CA 121.884 1.722 . . . . 0.0 109.494 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 56.1 mt 89.91 -21.93 0.12 Allowed 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 131.379 3.871 . . . . 0.0 110.444 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 9.2 t -113.26 -8.08 13.52 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 119.157 0.89 . . . . 0.0 112.733 171.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.11 -43.38 87.15 Favored 'General case' 0 C--O 1.235 0.318 0 O-C-N 121.521 -0.737 . . . . 0.0 111.627 -175.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -62.18 -29.18 70.18 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 174.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ttt85 -76.55 -32.52 58.24 Favored 'General case' 0 CA--C 1.52 -0.18 0 C-N-CA 124.591 1.156 . . . . 0.0 112.006 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 36.2 t -74.57 -34.69 62.97 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 168.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.554 0 O-C-N 120.486 -1.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.732 0 CA-C-O 119.025 -0.875 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -50.18 -51.16 46.14 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 124.118 0.967 . . . . 0.0 112.823 -168.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.1 m -56.54 -27.91 58.75 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.9 p -96.31 -17.81 20.43 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.92 132.64 21.81 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-N 120.724 1.602 . . . . 0.0 110.405 -168.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -59.48 129.38 30.89 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.93 2.42 . . . . 0.0 110.851 -177.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.0 mt 93.51 -16.23 0.12 Allowed 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 131.682 3.993 . . . . 0.0 111.39 -176.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 4.1 t -110.42 -12.62 14.39 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.963 1.71 . . . . 0.0 112.931 165.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.64 79.91 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.685 -0.635 . . . . 0.0 110.26 -178.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 4.2 p-90 -60.73 -19.95 60.05 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 tpt180 -76.1 -4.74 43.11 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.096 1.758 . . . . 0.0 111.83 175.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 19.8 t -63.82 -32.64 74.22 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 120.435 1.47 . . . . 0.0 111.413 -166.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.579 0 O-C-N 121.338 -0.851 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.783 0 N-CA-C 110.706 -0.958 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.427 ' HA ' ' HB3' ' A' ' 8' ' ' CYS . 1.6 m -45.39 -61.55 1.63 Allowed 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 127.876 2.47 . . . . 0.0 114.542 -168.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -58.52 -26.94 64.03 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -170.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 p -96.16 -4.68 42.22 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.212 1.405 . . . . 0.0 114.066 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -115.8 148.45 41.24 Favored Pre-proline 0 N--CA 1.448 -0.575 0 CA-C-N 120.979 1.718 . . . . 0.0 112.237 -171.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -88.02 33.48 0.4 Allowed 'Trans proline' 0 N--CA 1.46 -0.475 0 C-N-CA 123.263 2.642 . . . . 0.0 112.514 -174.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.3 pp -143.6 15.8 1.8 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.322 1.049 . . . . 0.0 110.463 173.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' HA ' ' A' ' 2' ' ' CYS . 31.6 t -155.81 -9.68 0.11 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 114.567 1.321 . . . . 0.0 114.567 170.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.72 14.95 0.22 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.125 -1.609 . . . . 0.0 113.887 -175.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 11.7 p-90 -48.34 -32.45 7.48 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 125.126 1.37 . . . . 0.0 114.041 176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -163.27 35.34 0.09 Allowed 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.453 1.101 . . . . 0.0 110.408 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 10.8 t 74.04 -35.6 0.31 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.006 2.523 . . . . 0.0 113.458 174.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.668 0 O-C-N 120.304 -1.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.781 0 N-CA-C 108.938 -1.665 . . . . 0.0 108.938 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.13 -21.17 1.87 Allowed 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.747 0.819 . . . . 0.0 111.781 154.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -58.71 -50.26 74.54 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.126 0.875 . . . . 0.0 111.591 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 p -88.11 -51.08 5.99 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.945 0.498 . . . . 0.0 111.2 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -66.39 107.62 1.74 Allowed Pre-proline 0 CA--C 1.535 0.397 0 C-N-CA 124.716 1.206 . . . . 0.0 108.836 177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -71.75 176.78 7.74 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 123.479 2.786 . . . . 0.0 113.889 -158.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.8 mt 80.6 -16.45 0.65 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 130.539 3.536 . . . . 0.0 111.428 -179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.73 17.25 10.28 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.973 1.309 . . . . 0.0 111.283 167.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.22 -42.52 77.37 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.686 0.794 . . . . 0.0 111.369 177.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -55.93 -21.39 20.42 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.9 tpp85 -75.92 -9.3 58.49 Favored 'General case' 0 N--CA 1.463 0.213 0 O-C-N 120.859 -1.15 . . . . 0.0 111.669 175.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 13.9 t -64.52 -23.34 67.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.149 0.98 . . . . 0.0 110.603 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 O-C-N 120.459 -1.401 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.765 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -44.85 89.42 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 124.226 1.011 . . . . 0.0 111.733 -177.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 62.7 m -65.66 -20.83 66.45 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.115 -0.991 . . . . 0.0 112.672 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.4 p -96.63 -28.52 14.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 118.062 -0.97 . . . . 0.0 113.313 -179.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.69 122.46 86.6 Favored Pre-proline 0 N--CA 1.451 -0.39 0 CA-C-N 120.757 1.617 . . . . 0.0 107.634 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -77.25 31.59 0.42 Allowed 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.708 2.939 . . . . 0.0 113.667 -166.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.6 pp -143.19 10.47 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.66 1.584 . . . . 0.0 109.964 170.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 44.8 t -125.84 -16.37 5.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.087 1.755 . . . . 0.0 111.675 158.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -56.36 -33.68 65.92 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.156 1.382 . . . . 0.0 112.211 -177.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 1.6 p-90 -55.7 -28.24 54.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 172.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 11.5 ttt85 -163.85 69.88 0.2 Allowed 'General case' 0 C--O 1.238 0.477 0 C-N-CA 124.147 0.979 . . . . 0.0 109.132 -175.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 28.1 p -75.66 -173.26 2.13 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 160.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.319 -0.727 0 O-C-N 120.052 -1.655 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_