data_1c2u_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 1c2u _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 ' 12' ' ' CYS . . . . . 0.828 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 106.951 -1.5 . . . . 1.0 106.951 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.61 151.31 29.58 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 117.992 -1.004 . . . . 1.0 110.377 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.46 -11.05 50.13 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.522 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -81.92 2.01 32.58 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.733 -1.21 . . . . 1.0 107.733 179.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.47 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -151.5 -66.97 0.18 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.227 0.955 . . . . 1.0 111.986 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.7 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.8 t -29.57 -44.56 0.04 OUTLIER 'General case' 0 N--CA 1.52 3.032 0 CA-C-O 123.229 1.49 . . . . 1.0 112.951 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.21 71.22 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 110.709 -2.951 . . . . 1.0 113.437 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.522 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 85.5 m-70 -29.56 -84.44 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 114.841 1.423 . . . . 1.0 114.841 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.83 78.26 2.75 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.727 1.727 . . . . 1.0 110.778 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.72 -12.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 112.367 -2.197 . . . . 1.0 110.035 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -54.34 -20.15 6.75 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 118.066 -1.454 . . . . 1.0 113.512 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.496 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 29.6 p90 -96.97 5.06 51.16 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 122.105 0.955 . . . . 1.0 109.659 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.496 ' HD3' ' CE1' ' A' ' 23' ' ' TYR . 11.6 mtp85 -109.49 -48.02 3.3 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.946 -1.479 . . . . 1.0 108.14 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.5 ' CG ' ' HD3' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -90.78 -79.06 0.37 Allowed 'General case' 0 N--CA 1.481 1.123 1 N-CA-C 98.769 -4.53 . . . . 1.0 98.769 178.989 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.404 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.7 m 178.71 -43.81 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.824 -1.547 . . . . 1.0 106.824 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -159.77 -64.5 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.529 -1.668 . . . . 1.0 113.959 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -111.53 155.84 22.65 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 112.433 -2.167 . . . . 1.0 111.408 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.7 ttp180 -176.55 -89.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 116.874 2.176 . . . . 1.0 116.874 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -39.9 -42.53 1.35 Allowed 'General case' 0 N--CA 1.521 3.107 0 N-CA-C 116.622 2.082 . . . . 1.0 116.622 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.7 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 6.9 m -105.21 1.33 28.1 Favored 'General case' 0 N--CA 1.513 2.689 0 CA-C-O 124.449 2.071 . . . . 1.0 111.843 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 5.0 m . . . . . 0 C--N 1.282 -2.363 0 CA-C-N 109.704 -3.407 . . . . 1.0 115.238 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.78 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 102.41 -3.181 . . . . 1.0 102.41 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.459 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -148.92 153.27 37.76 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 113.394 -1.73 . . . . 1.0 109.252 -179.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.72 10.22 4.29 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 105.414 -2.069 . . . . 1.0 105.414 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.558 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -101.95 -0.54 33.66 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 105.233 -2.136 . . . . 1.0 105.233 179.559 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.447 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -158.3 -52.03 0.07 Allowed 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.652 0.612 . . . . 1.0 112.652 178.674 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.0 t -29.86 -55.74 0.17 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 124.952 1.407 . . . . 1.0 110.687 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -168.61 77.87 0.13 Allowed 'General case' 0 N--CA 1.488 1.454 1 O-C-N 129.389 4.18 . . . . 1.0 109.892 -179.607 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.544 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -29.92 -87.84 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.971 2.212 . . . . 1.0 116.971 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.24 77.0 0.25 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 123.245 1.498 . . . . 1.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.8 -12.8 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.274 -1.785 . . . . 1.0 109.066 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -55.51 -19.69 10.54 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.163 -1.415 . . . . 1.0 111.725 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -95.97 11.47 33.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.415 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -120.4 -47.32 2.35 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 113.78 -1.555 . . . . 1.0 109.054 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -91.5 -74.07 0.52 Allowed 'General case' 0 C--N 1.312 -1.026 1 N-CA-C 99.311 -4.329 . . . . 1.0 99.311 179.09 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.4 ' H ' HD21 ' A' ' 25' ' ' LEU . 1.6 m 178.01 -50.85 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 123.702 1.715 . . . . 1.0 107.777 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -161.08 -63.28 0.06 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.296 -3.138 . . . . 1.0 111.901 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.768 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 m -109.82 137.2 47.95 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 113.578 -1.646 . . . . 1.0 114.0 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.533 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 10.1 ttp180 -166.91 -56.4 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 N-CA-C 116.879 2.177 . . . . 1.0 116.879 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.404 ' C ' ' H ' ' A' ' 32' ' ' CYS . 70.0 tttt -66.25 -79.22 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.62 0 C-N-CA 117.323 -1.751 . . . . 1.0 108.285 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.597 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 59.5 m -59.21 -12.55 5.5 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-O 122.428 1.109 . . . . 1.0 110.257 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.78 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 1.7 m . . . . . 0 C--N 1.291 -1.971 0 N-CA-C 117.73 2.492 . . . . 1.0 117.73 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 105.13 -2.174 . . . . 1.0 105.13 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.474 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -147.97 150.33 33.82 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 117.495 -1.241 . . . . 1.0 109.997 -179.597 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -10.84 41.4 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 105.758 -1.942 . . . . 1.0 105.758 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.474 ' CD2' ' OG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -81.9 1.7 33.94 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.433 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.406 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -157.34 -60.28 0.09 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.328 1.018 . . . . 1.0 112.432 179.254 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.747 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.7 t -30.61 -45.21 0.06 Allowed 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.05 75.21 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 127.86 3.225 . . . . 1.0 113.772 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.459 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 73.8 m-70 -28.8 -94.21 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 118.601 2.815 . . . . 1.0 118.601 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.17 34.71 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.847 1.425 . . . . 1.0 114.847 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' LYS . . . -139.12 0.93 1.98 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 117.857 -1.068 . . . . 1.0 108.318 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.418 ' HG3' ' N ' ' A' ' 23' ' ' TYR . 15.6 pttp -50.08 -52.34 35.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 116.511 -2.075 . . . . 1.0 108.074 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.418 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 25.3 p90 -62.83 -8.89 7.77 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 114.338 -1.301 . . . . 1.0 112.305 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 mtp85 -97.39 -36.92 10.21 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 118.163 -0.922 . . . . 1.0 110.752 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.525 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -102.03 -58.1 1.94 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.067 -2.197 . . . . 1.0 105.067 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 177.85 -67.56 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 124.44 2.067 . . . . 1.0 106.115 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -157.09 -52.11 0.07 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 108.47 -3.968 . . . . 1.0 112.866 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.778 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -117.93 151.01 38.27 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.383 -1.281 . . . . 1.0 109.143 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.525 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.2 tmm_? -167.75 -88.54 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 117.796 2.517 . . . . 1.0 117.796 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HE3' ' OG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -49.96 -22.85 1.7 Allowed 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 117.631 2.456 . . . . 1.0 117.631 -179.316 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.747 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 5.3 m -114.51 -0.49 13.7 Favored 'General case' 0 N--CA 1.513 2.683 0 CA-C-O 124.574 2.13 . . . . 1.0 110.253 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 12' ' ' CYS 0.267 15.5 m . . . . . 0 C--N 1.285 -2.204 0 CA-C-N 108.87 -3.786 . . . . 1.0 108.956 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.773 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 104.114 -2.55 . . . . 1.0 104.114 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -158.82 158.0 32.67 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 105.426 -2.064 . . . . 1.0 105.426 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.71 26.34 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 105.532 -2.025 . . . . 1.0 105.532 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.535 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -90.86 2.42 56.16 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 105.867 -1.901 . . . . 1.0 105.867 179.519 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -154.92 -60.81 0.12 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 112.313 0.486 . . . . 1.0 112.313 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.553 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.7 t -31.1 -53.29 0.2 Allowed 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 123.855 1.788 . . . . 1.0 110.33 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.87 71.06 0.14 Allowed 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 111.347 -2.66 . . . . 1.0 113.547 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.535 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.76 -79.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.983 1.105 . . . . 1.0 113.983 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.46 71.6 1.82 Allowed 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 123.981 1.848 . . . . 1.0 113.226 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.48 -10.81 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 112.27 -2.241 . . . . 1.0 109.68 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.3 pttt -55.91 -19.26 11.38 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 116.614 -2.034 . . . . 1.0 113.099 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -94.3 2.58 55.84 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 122.083 0.944 . . . . 1.0 110.245 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -109.46 -46.59 3.52 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 113.462 -1.699 . . . . 1.0 112.341 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.469 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.54 -72.19 0.58 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 101.455 -3.535 . . . . 1.0 101.455 179.625 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.7 m 179.58 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.022 -1.473 . . . . 1.0 107.022 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -162.61 -58.64 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 113.241 -1.8 . . . . 1.0 111.302 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.761 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.08 155.41 23.9 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.209 -1.359 . . . . 1.0 109.927 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.566 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 9.5 ttp85 -177.83 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 O-C-N 125.095 1.497 . . . . 1.0 113.539 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -35.65 -44.47 0.32 Allowed 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 119.958 3.318 . . . . 1.0 119.958 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.553 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.8 m -101.26 -5.72 25.13 Favored 'General case' 0 N--CA 1.508 2.44 0 CA-C-O 123.454 1.597 . . . . 1.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.773 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 6.7 m . . . . . 0 C--N 1.287 -2.13 0 CA-C-N 110.652 -2.976 . . . . 1.0 115.193 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 105.135 -2.172 . . . . 1.0 105.135 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.408 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -147.66 163.37 36.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 179.59 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.92 -1.62 40.14 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 106.111 -1.811 . . . . 1.0 106.111 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.528 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -90.51 1.18 56.95 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 104.609 -2.367 . . . . 1.0 104.609 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.436 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -152.59 -61.34 0.15 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.0 t -29.97 -52.21 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 123.947 1.832 . . . . 1.0 110.303 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -168.9 79.31 0.13 Allowed 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 110.941 -2.845 . . . . 1.0 112.463 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.93 -78.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.782 1.771 . . . . 1.0 115.782 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.17 40.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 118.625 2.824 . . . . 1.0 118.625 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.437 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -148.48 2.18 0.63 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.349 -1.47 . . . . 1.0 108.388 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.2 pttm -59.32 -28.96 67.28 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 116.881 -1.928 . . . . 1.0 108.35 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -87.22 9.01 21.52 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 113.82 -1.536 . . . . 1.0 110.282 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.437 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 4.0 mtp85 -114.62 -49.69 2.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.453 -1.249 . . . . 1.0 110.884 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -91.77 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 103.434 -2.802 . . . . 1.0 103.434 179.407 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.495 ' H ' HD23 ' A' ' 25' ' ' LEU . 27.7 m 179.75 -51.91 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 105.431 -2.063 . . . . 1.0 105.431 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -160.33 -66.12 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.783 -2.008 . . . . 1.0 109.33 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.807 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -103.11 156.96 17.32 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 111.764 -2.471 . . . . 1.0 111.987 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.505 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 ttm180 179.03 -88.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 115.045 1.498 . . . . 1.0 115.045 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.29 -38.91 1.26 Allowed 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 118.412 2.745 . . . . 1.0 118.412 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 32.1 m -104.41 -5.0 22.1 Favored 'General case' 0 N--CA 1.508 2.425 0 CA-C-O 122.693 1.235 . . . . 1.0 108.025 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 23.7 m . . . . . 0 C--N 1.286 -2.155 0 CA-C-N 112.411 -2.177 . . . . 1.0 116.279 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.763 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.279 0 N-CA-C 105.211 -2.144 . . . . 1.0 105.211 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.472 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -148.3 163.59 36.6 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 105.338 -2.097 . . . . 1.0 105.338 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.96 19.86 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 116.988 -1.885 . . . . 1.0 106.088 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -98.72 1.94 46.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 105.938 -1.875 . . . . 1.0 105.938 179.528 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.45 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -150.74 -62.85 0.19 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 123.516 0.51 . . . . 1.0 109.815 178.12 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.711 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -37.79 -51.3 1.27 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 125.075 1.484 . . . . 1.0 111.301 -179.748 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.88 68.57 0.18 Allowed 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 116.012 -2.275 . . . . 1.0 114.122 -179.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.556 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 90.4 m-70 -28.38 -85.16 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 125.034 1.459 . . . . 1.0 114.797 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.465 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.39 46.65 0.27 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 114.375 1.25 . . . . 1.0 114.375 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.524 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . . . -158.48 -0.32 0.09 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.792 -1.549 . . . . 1.0 107.943 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -56.0 -21.9 23.88 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 116.7 -2.0 . . . . 1.0 111.628 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.58 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 6.6 p90 -94.68 4.0 54.37 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 124.281 0.988 . . . . 1.0 110.662 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.58 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.5 tpp180 -100.76 -49.81 4.05 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.672 -0.862 . . . . 1.0 108.672 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.512 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -86.33 -68.87 0.71 Allowed 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 106.654 -1.61 . . . . 1.0 106.654 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.3 m 178.98 -49.83 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 105.19 -2.152 . . . . 1.0 105.19 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -167.27 -50.47 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 109.513 -3.494 . . . . 1.0 109.989 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.81 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -116.95 144.31 44.7 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 117.212 2.301 . . . . 1.0 117.212 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.545 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.3 ttm180 -170.11 -84.99 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 118.271 2.693 . . . . 1.0 118.271 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.3 mmtm -43.94 -23.83 0.11 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 119.425 3.12 . . . . 1.0 119.425 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.711 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 97.0 m -116.91 -8.66 11.27 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 123.795 1.759 . . . . 1.0 108.382 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.81 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 4.4 m . . . . . 0 C--N 1.288 -2.066 0 CA-C-N 112.104 -2.316 . . . . 1.0 114.621 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.777 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 107.662 -1.236 . . . . 1.0 107.662 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.478 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -146.93 155.34 42.21 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 103.12 -2.918 . . . . 1.0 103.12 179.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.7 11.11 3.37 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 116.518 -2.073 . . . . 1.0 105.506 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.525 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -100.76 1.78 40.65 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.786 -1.931 . . . . 1.0 105.786 179.572 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.4 ' O ' ' C ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -155.28 -59.85 0.11 Allowed 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.938 -0.705 . . . . 1.0 110.714 178.568 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.777 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -34.86 -57.82 0.53 Allowed 'General case' 0 N--CA 1.485 1.282 0 O-C-N 125.21 1.569 . . . . 1.0 110.453 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -162.5 72.06 0.33 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 112.396 -2.184 . . . . 1.0 113.022 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.502 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.51 -75.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 115.649 1.722 . . . . 1.0 115.649 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.35 44.16 0.25 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 115.342 1.608 . . . . 1.0 115.342 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.545 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -146.32 4.06 0.91 Allowed 'General case' 0 C--N 1.299 -1.627 0 C-N-CA 118.62 -1.232 . . . . 1.0 109.242 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -62.81 -21.81 66.18 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 115.441 -2.504 . . . . 1.0 106.45 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -97.7 10.81 39.06 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.156 -1.384 . . . . 1.0 110.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.545 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -105.49 -51.28 3.04 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.104 -1.073 . . . . 1.0 108.104 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.488 ' CD2' ' H ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -98.04 -99.8 0.21 Allowed 'General case' 0 C--N 1.306 -1.288 1 N-CA-C 97.792 -4.892 . . . . 1.0 97.792 179.31 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.488 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 71.1 m -139.82 -47.54 0.45 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 106.433 -1.692 . . . . 1.0 106.433 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -152.81 -61.86 0.15 Allowed 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.018 -1.901 . . . . 1.0 109.152 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.449 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.3 m -112.07 147.51 35.87 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 117.444 2.387 . . . . 1.0 117.444 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.836 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -151.77 -86.85 0.07 Allowed 'General case' 0 CA--C 1.571 1.778 0 CA-C-N 113.183 -1.826 . . . . 1.0 112.099 178.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 7.6 tptp -31.0 -53.42 0.2 Allowed 'General case' 0 N--CA 1.513 2.709 1 N-CA-C 124.131 4.863 . . . . 1.0 124.131 -179.635 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.625 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 3.5 m -113.26 4.98 16.72 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-O 125.505 2.574 . . . . 1.0 112.405 -179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.836 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.278 -2.51 1 CA-C-N 107.977 -4.192 . . . . 1.0 112.703 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.72 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 N-CA-C 104.12 -2.548 . . . . 1.0 104.12 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -150.56 160.29 43.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.679 -0.859 . . . . 1.0 108.679 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.96 5.8 13.0 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 106.886 -1.524 . . . . 1.0 106.886 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.509 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -101.77 2.19 38.14 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.144 -2.169 . . . . 1.0 105.144 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -52.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 114.739 1.385 . . . . 1.0 114.739 178.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.4 t -29.3 -49.69 0.09 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 124.833 1.333 . . . . 1.0 111.442 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.484 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 2.0 tppt? -178.33 82.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 110.781 -2.918 . . . . 1.0 108.521 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.509 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.3 m-70 -32.0 -84.8 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 115.992 1.849 . . . . 1.0 115.992 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -61.95 30.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 118.142 2.645 . . . . 1.0 118.142 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.484 ' CB ' ' HG3' ' A' ' 18' ' ' LYS . . . -146.89 4.24 0.84 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.948 -1.871 . . . . 1.0 105.948 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -56.35 -30.79 63.08 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 117.023 -1.871 . . . . 1.0 107.079 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.574 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 25.5 p90 -85.69 6.39 27.86 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 115.588 -0.733 . . . . 1.0 112.573 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.574 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.3 tpp180 -103.1 -47.61 4.29 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.756 -1.572 . . . . 1.0 106.756 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.486 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.6 -71.79 0.61 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 101.527 -3.508 . . . . 1.0 101.527 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m 178.63 -47.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 106.192 -1.781 . . . . 1.0 106.192 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -158.94 -65.66 0.08 Allowed 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 111.969 -2.378 . . . . 1.0 109.201 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.797 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.5 m -111.24 143.22 42.36 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 110.199 -3.182 . . . . 1.0 112.943 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.528 ' CA ' ' HB2' ' A' ' 32' ' ' CYS . 0.8 OUTLIER 179.71 -34.71 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.173 2.286 . . . . 1.0 117.173 179.207 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 1.4 tmtp? -83.96 -53.86 5.27 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 122.245 2.293 . . . . 1.0 109.519 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.6 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 90.2 m -84.41 -4.34 58.85 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 105.004 -2.221 . . . . 1.0 105.004 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.797 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.5 m . . . . . 0 C--N 1.294 -1.84 0 CA-C-N 112.127 -2.306 . . . . 1.0 115.368 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 123.536 1.636 . . . . 1.0 106.925 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.426 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -135.08 161.2 35.98 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 103.478 -2.786 . . . . 1.0 103.478 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.96 0.26 21.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 104.872 -2.27 . . . . 1.0 104.872 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.59 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -94.52 4.0 54.41 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.924 -1.509 . . . . 1.0 106.924 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.426 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.14 -60.05 0.16 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.084 -0.962 . . . . 1.0 112.589 178.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.543 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.8 t -30.92 -47.49 0.1 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -173.89 74.34 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 109.861 -3.336 . . . . 1.0 112.263 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.59 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.6 m-70 -29.45 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 116.734 2.124 . . . . 1.0 116.734 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.35 41.29 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.759 2.503 . . . . 1.0 117.759 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -146.92 0.87 0.75 Allowed 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 107.993 -1.114 . . . . 1.0 107.993 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -58.16 -28.55 64.84 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 116.184 -2.206 . . . . 1.0 109.585 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -84.57 2.98 38.83 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.902 -1.044 . . . . 1.0 110.189 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -110.27 -47.56 3.28 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 113.878 -1.51 . . . . 1.0 112.519 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.537 ' HG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.9 -65.49 0.98 Allowed 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 103.552 -2.759 . . . . 1.0 103.552 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.484 ' H ' HD21 ' A' ' 25' ' ' LEU . 0.4 OUTLIER 178.73 -55.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 105.171 -2.159 . . . . 1.0 105.171 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -157.18 -63.22 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 111.028 -2.806 . . . . 1.0 109.395 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.788 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -102.59 162.12 13.18 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 112.194 -2.276 . . . . 1.0 112.044 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.537 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 8.2 ttp85 177.59 -92.51 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 125.311 1.444 . . . . 1.0 111.897 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.92 -50.85 0.22 Allowed 'General case' 0 N--CA 1.51 2.572 0 N-CA-C 117.945 2.572 . . . . 1.0 117.945 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.543 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 7.5 m -97.56 -2.32 41.99 Favored 'General case' 0 N--CA 1.514 2.754 0 CA-C-N 113.842 -1.526 . . . . 1.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 30.1 m . . . . . 0 C--N 1.28 -2.418 0 CA-C-N 110.8 -2.909 . . . . 1.0 115.833 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.757 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.3 p . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 103.765 -2.68 . . . . 1.0 103.765 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.445 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -151.13 159.67 44.32 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.47 1.85 15.36 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 105.265 -2.124 . . . . 1.0 105.265 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -96.63 1.67 51.41 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 105.103 -2.184 . . . . 1.0 105.103 179.337 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -61.1 0.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.078 0.77 . . . . 1.0 113.078 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.7 t -29.4 -54.39 0.14 Allowed 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 124.324 2.012 . . . . 1.0 111.583 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.21 75.09 0.15 Allowed 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 110.484 -3.053 . . . . 1.0 111.093 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.6 m-70 -29.19 -79.66 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.124 1.898 . . . . 1.0 116.124 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.21 36.7 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 119.221 3.045 . . . . 1.0 119.221 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -144.93 1.15 0.98 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.588 -1.245 . . . . 1.0 108.118 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -58.36 -32.78 68.87 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 116.837 -1.945 . . . . 1.0 110.76 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -80.17 0.52 31.96 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.755 -1.566 . . . . 1.0 109.824 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -111.74 -46.37 3.25 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 114.903 1.446 . . . . 1.0 114.903 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.517 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.77 -67.74 0.82 Allowed 'General case' 0 N--CA 1.483 1.196 1 N-CA-C 99.789 -4.152 . . . . 1.0 99.789 179.597 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.439 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.6 m 178.38 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.563 -1.643 . . . . 1.0 106.563 179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -161.0 -62.37 0.06 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 113.317 -1.765 . . . . 1.0 111.16 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.798 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.53 136.19 52.34 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 111.924 -2.398 . . . . 1.0 110.647 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.517 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -164.75 -50.08 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 116.015 1.857 . . . . 1.0 116.015 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.479 ' C ' ' H ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -66.1 -83.54 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.932 -1.107 . . . . 1.0 108.058 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.571 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 14.8 m -59.25 -9.43 2.19 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 122.964 1.364 . . . . 1.0 110.571 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.798 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m . . . . . 0 C--N 1.293 -1.864 0 CA-C-N 112.078 -2.328 . . . . 1.0 116.318 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.771 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 102.975 -2.972 . . . . 1.0 102.975 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.479 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -159.64 138.45 10.8 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 116.058 -1.925 . . . . 1.0 109.109 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.39 -12.32 1.62 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 117.907 -1.517 . . . . 1.0 108.193 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.509 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -83.15 4.43 26.59 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.24 -0.913 . . . . 1.0 111.129 179.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.58 -61.0 0.1 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.597 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.772 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.1 OUTLIER -36.29 -46.14 0.51 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 113.972 -1.467 . . . . 1.0 113.832 -179.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.3 70.47 0.06 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.536 -2.575 . . . . 1.0 113.083 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 81.8 m-70 -28.61 -92.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 117.508 2.41 . . . . 1.0 117.508 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.464 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.81 56.92 0.75 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.289 -0.869 . . . . 1.0 113.266 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -156.36 -9.52 0.1 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.973 -1.467 . . . . 1.0 108.591 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -54.5 -22.46 12.98 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 118.321 -1.352 . . . . 1.0 111.131 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.513 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 27.7 p90 -93.94 8.01 42.92 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.882 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.513 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.1 tpp180 -108.4 -48.37 3.35 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 106.233 -1.765 . . . . 1.0 106.233 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.439 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -93.19 -77.81 0.44 Allowed 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 101.825 -3.398 . . . . 1.0 101.825 179.368 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER 178.99 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.9 -1.519 . . . . 1.0 106.9 179.581 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.413 ' CG ' ' O ' ' A' ' 26' ' ' SER . 50.6 m-85 -163.43 -59.45 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 111.62 -2.536 . . . . 1.0 112.04 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.499 ' SG ' ' C ' ' A' ' 12' ' ' CYS . 1.2 m -127.19 124.18 38.39 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 119.886 3.291 . . . . 1.0 119.886 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.888 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.4 ttm180 -139.33 -87.41 0.22 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -29.52 -69.81 0.06 Allowed 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 119.386 3.106 . . . . 1.0 119.386 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.772 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 25.3 m -86.65 0.54 54.34 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 125.175 2.417 . . . . 1.0 109.867 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.888 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.351 0 CA-C-N 109.567 -3.47 . . . . 1.0 113.249 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.753 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 108.454 -0.943 . . . . 1.0 108.454 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -153.49 156.62 38.46 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.506 0.504 . . . . 1.0 110.168 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.56 -4.54 34.67 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.512 -1.292 . . . . 1.0 107.512 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -93.08 0.38 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.29 -1.374 . . . . 1.0 107.29 179.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -151.67 -60.32 0.17 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.172 0.92 . . . . 1.0 112.844 178.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.562 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.1 t -29.77 -50.67 0.11 Allowed 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 122.85 1.31 . . . . 1.0 110.509 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -172.55 76.73 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 111.062 -2.79 . . . . 1.0 112.506 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.551 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.8 m-70 -29.73 -81.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 116.09 1.885 . . . . 1.0 116.09 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.66 61.27 1.8 Allowed 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 116.965 2.209 . . . . 1.0 116.965 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' C ' ' A' ' 22' ' ' LYS . . . -169.31 -7.03 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 112.107 -2.315 . . . . 1.0 109.599 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.429 ' C ' ' O ' ' A' ' 21' ' ' ALA . 14.3 pttt -48.49 -54.29 14.8 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 116.497 -2.081 . . . . 1.0 108.906 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -59.85 -4.16 0.66 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 124.723 1.265 . . . . 1.0 113.301 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 -105.18 -41.81 5.46 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.965 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.06 -65.18 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 1 N-CA-C 99.802 -4.147 . . . . 1.0 99.802 179.192 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 177.66 -59.13 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.532 0 O-C-N 125.968 2.043 . . . . 1.0 106.756 179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -157.15 -64.37 0.1 Allowed 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.484 -2.144 . . . . 1.0 111.738 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -103.93 153.93 20.23 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 112.766 -2.015 . . . . 1.0 107.259 -179.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.547 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -178.17 -89.35 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.957 1.303 . . . . 1.0 113.135 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -30.66 -49.67 0.12 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.991 2.589 . . . . 1.0 117.991 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.562 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 44.2 m -104.4 -4.62 22.58 Favored 'General case' 0 N--CA 1.51 2.531 0 CA-C-N 112.786 -2.006 . . . . 1.0 111.303 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 7.0 m . . . . . 0 C--N 1.282 -2.367 0 CA-C-N 111.113 -2.767 . . . . 1.0 114.725 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.73 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.442 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -139.29 151.77 46.71 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.551 -2.018 . . . . 1.0 105.551 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.408 ' O ' ' HA ' ' A' ' 19' ' ' HIS . . . -76.22 6.98 4.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.721 -1.992 . . . . 1.0 105.675 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -95.38 1.4 54.23 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 105.45 -2.056 . . . . 1.0 105.45 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.414 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.28 -62.0 0.1 Allowed 'General case' 0 C--N 1.306 -1.304 0 O-C-N 124.023 0.827 . . . . 1.0 112.08 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.73 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -29.79 -44.44 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 O-C-N 124.668 1.23 . . . . 1.0 113.299 -179.162 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 8.1 tppt? -179.19 72.88 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 112.307 -2.224 . . . . 1.0 110.411 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.506 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 84.9 m-70 -29.13 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 116.825 2.158 . . . . 1.0 116.825 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.6 71.04 4.06 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 123.177 1.465 . . . . 1.0 110.003 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HA ' ' CZ ' ' A' ' 24' ' ' ARG . . . -167.89 -11.38 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 112.861 -1.972 . . . . 1.0 110.697 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.495 ' HA ' ' CD2' ' A' ' 25' ' ' LEU . 25.0 pttm -47.57 -44.49 26.27 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 118.395 -1.322 . . . . 1.0 109.942 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 42.9 p90 -70.57 1.54 5.07 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.294 -1.321 . . . . 1.0 113.241 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.464 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.9 ttp180 -107.54 -54.74 2.44 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 114.683 -1.144 . . . . 1.0 109.356 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.578 ' CG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -80.09 -71.25 0.46 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 103.596 -2.742 . . . . 1.0 103.596 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m 177.98 -52.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 103.258 -2.867 . . . . 1.0 103.258 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.404 ' C ' HD21 ' A' ' 25' ' ' LEU . 46.5 m-85 -155.06 -50.89 0.09 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.472 -3.058 . . . . 1.0 109.927 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.471 ' SG ' ' C ' ' A' ' 12' ' ' CYS . 1.6 m -120.69 146.27 46.6 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 115.295 1.591 . . . . 1.0 115.295 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.747 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -162.85 -31.19 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 116.517 2.043 . . . . 1.0 116.517 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 tptm -100.26 -42.0 6.84 Favored 'General case' 0 N--CA 1.525 3.293 0 N-CA-C 119.601 3.186 . . . . 1.0 119.601 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.712 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 73.2 m -103.69 7.78 37.37 Favored 'General case' 0 N--CA 1.525 3.292 0 CA-C-O 125.598 2.618 . . . . 1.0 109.215 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.747 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.355 1 CA-C-N 108.105 -4.134 . . . . 1.0 112.481 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 106.708 -1.59 . . . . 1.0 106.708 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.93 156.55 42.44 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 114.833 -1.076 . . . . 1.0 108.547 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.66 -0.67 34.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 105.762 -1.94 . . . . 1.0 105.762 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -91.59 1.76 56.92 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 105.927 -1.879 . . . . 1.0 105.927 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.91 -56.63 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 178.439 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.9 t -30.37 -52.87 0.16 Allowed 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 125.699 2.666 . . . . 1.0 111.881 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HZ2' ' CB ' ' A' ' 30' ' ' LYS . 1.2 tppm? -168.04 74.26 0.12 Allowed 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 109.92 -3.309 . . . . 1.0 111.601 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.464 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 92.1 m-70 -29.66 -79.01 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 114.803 1.408 . . . . 1.0 114.803 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.86 27.68 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 118.462 2.764 . . . . 1.0 118.462 -179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.412 ' O ' ' CD2' ' A' ' 25' ' ' LEU . . . -141.12 2.91 1.75 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -62.88 -21.7 66.17 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 116.879 -1.929 . . . . 1.0 108.78 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -95.79 7.9 45.02 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.472 -1.24 . . . . 1.0 108.681 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.433 ' HB3' HH21 ' A' ' 24' ' ' ARG . 4.5 mtp85 -111.05 -46.95 3.26 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 114.692 -1.14 . . . . 1.0 111.308 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.519 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.22 -88.02 0.25 Allowed 'General case' 0 N--CA 1.485 1.283 1 N-CA-C 96.999 -5.186 . . . . 1.0 96.999 179.177 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.481 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 20.2 m -161.49 -46.42 0.04 OUTLIER 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.941 -1.503 . . . . 1.0 106.941 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -162.78 -58.14 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 123.55 1.643 . . . . 1.0 111.736 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.791 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -116.25 131.44 56.94 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 111.078 -2.783 . . . . 1.0 112.745 -179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.539 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 11.9 ttp85 -161.13 -49.63 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 N-CA-C 115.869 1.803 . . . . 1.0 115.869 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.498 ' C ' ' H ' ' A' ' 32' ' ' CYS . 3.8 tmtt? -70.17 -79.07 0.07 Allowed 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 117.708 -1.597 . . . . 1.0 107.487 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.595 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -59.49 -9.86 2.85 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 123.491 1.615 . . . . 1.0 109.672 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.791 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 2.5 m . . . . . 0 C--N 1.295 -1.793 0 CA-C-N 111.925 -2.398 . . . . 1.0 116.8 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.78 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.935 0 N-CA-C 103.748 -2.686 . . . . 1.0 103.748 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.473 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -152.38 143.3 23.0 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 116.881 -1.533 . . . . 1.0 107.924 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.07 -13.24 6.29 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 117.67 -1.612 . . . . 1.0 107.022 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.508 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -80.98 7.92 9.62 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.538 0.685 . . . . 1.0 110.836 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.535 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -164.8 -62.03 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.05 -1.432 . . . . 1.0 111.614 178.352 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.78 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -33.02 -50.02 0.26 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.874 1.321 . . . . 1.0 110.451 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.499 ' HA ' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -161.57 62.29 0.26 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.428 -2.169 . . . . 1.0 115.342 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.535 ' NE2' ' HA ' ' A' ' 16' ' ' GLN . 91.7 m-70 -29.56 -84.02 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 113.836 1.05 . . . . 1.0 113.836 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.13 71.73 4.62 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 124.51 2.1 . . . . 1.0 108.576 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.548 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . 179.43 -10.0 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 111.81 -2.45 . . . . 1.0 109.43 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 21' ' ' ALA . 4.9 pttp -50.12 -45.64 53.12 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 115.617 -2.433 . . . . 1.0 107.621 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -70.57 7.01 1.19 Allowed 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.174 1.176 . . . . 1.0 114.174 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.548 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 3.3 mtp85 -108.73 -45.92 3.74 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.121 -1.066 . . . . 1.0 108.121 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.457 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.75 -62.58 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 105.937 -1.875 . . . . 1.0 105.937 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.421 ' H ' HD21 ' A' ' 25' ' ' LEU . 1.1 m 178.55 -55.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 103.29 -2.856 . . . . 1.0 103.29 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -152.56 -60.19 0.15 Allowed 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 111.159 -2.746 . . . . 1.0 108.493 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.486 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.1 m -119.14 148.08 43.47 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 111.655 -2.52 . . . . 1.0 116.537 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.898 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 7.5 tmm_? -176.93 -22.53 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 117.327 2.343 . . . . 1.0 117.327 178.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -84.58 -37.98 20.5 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 121.55 1.977 . . . . 1.0 114.405 -179.807 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.652 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 0.8 OUTLIER -103.9 -18.39 14.64 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 123.727 1.727 . . . . 1.0 108.611 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.898 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.316 0 CA-C-N 109.549 -3.478 . . . . 1.0 115.615 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 102.782 -3.044 . . . . 1.0 102.782 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.42 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -147.47 166.96 25.68 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 104.932 -2.247 . . . . 1.0 104.932 179.752 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.09 3.95 24.95 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 106.158 -1.793 . . . . 1.0 106.158 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.582 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -102.0 4.38 39.82 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 113.133 -1.849 . . . . 1.0 106.841 179.616 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.42 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.96 -58.02 0.15 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.107 178.153 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.63 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 3.1 t -36.38 -50.14 0.75 Allowed 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.132 1.444 . . . . 1.0 110.637 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -169.74 69.45 0.06 Allowed 'General case' 0 C--N 1.302 -1.478 0 CA-C-N 112.183 -2.281 . . . . 1.0 114.858 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.582 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.5 m-70 -29.73 -67.75 0.08 Allowed 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 123.241 1.496 . . . . 1.0 112.095 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -78.88 55.46 1.74 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 116.693 2.108 . . . . 1.0 116.693 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.28 -4.39 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 111.445 -2.616 . . . . 1.0 108.965 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 pttp -48.91 -53.58 19.03 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 115.784 -2.366 . . . . 1.0 108.122 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -61.67 0.83 0.29 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 113.304 -1.771 . . . . 1.0 113.349 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -109.45 -48.37 3.25 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 114.01 1.115 . . . . 1.0 114.01 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.3 -63.01 1.51 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 102.147 -3.279 . . . . 1.0 102.147 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.406 ' H ' HD22 ' A' ' 25' ' ' LEU . 0.8 OUTLIER 177.6 -58.92 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 102.349 -3.204 . . . . 1.0 102.349 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -157.64 -64.13 0.09 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 111.736 -2.484 . . . . 1.0 114.171 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.737 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.15 122.35 47.51 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.279 1.585 . . . . 1.0 115.279 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.63 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 tmm_? -149.46 -73.33 0.18 Allowed 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 117.946 2.572 . . . . 1.0 117.946 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.75 -31.68 0.86 Allowed 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 117.677 2.473 . . . . 1.0 117.677 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.581 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -112.92 -2.29 14.34 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 125.523 1.764 . . . . 1.0 110.333 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 12.2 m . . . . . 0 C--N 1.287 -2.121 0 CA-C-N 112.158 -2.292 . . . . 1.0 115.559 -179.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 106.122 -1.807 . . . . 1.0 106.122 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.458 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -144.85 158.77 43.68 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.014 -1.476 . . . . 1.0 107.014 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.04 6.35 11.71 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.251 -1.759 . . . . 1.0 106.251 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.557 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -99.85 1.84 43.33 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 104.472 -2.418 . . . . 1.0 104.472 179.255 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.458 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -62.26 0.16 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.674 0.99 . . . . 1.0 113.674 178.34 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.5 t -29.67 -48.89 0.09 Allowed 'General case' 0 N--CA 1.507 2.39 0 CA-C-O 123.493 1.616 . . . . 1.0 114.294 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -174.07 72.0 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 109.997 -3.274 . . . . 1.0 109.15 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.557 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 80.0 m-70 -28.99 -77.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 117.394 2.368 . . . . 1.0 117.394 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.98 49.5 0.55 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 116.079 1.881 . . . . 1.0 116.079 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.29 -3.36 0.42 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.443 -0.903 . . . . 1.0 109.208 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -57.38 -29.44 64.05 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 116.836 -1.946 . . . . 1.0 110.248 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -84.09 0.72 47.28 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 115.123 -0.944 . . . . 1.0 110.058 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.3 mtp85 -107.25 -49.48 3.26 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 114.444 -1.253 . . . . 1.0 112.357 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.569 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -96.1 -62.05 1.34 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 105.231 -2.137 . . . . 1.0 105.231 179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 1.2 m 178.77 -54.31 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.218 -1.401 . . . . 1.0 107.218 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.408 ' CG ' ' O ' ' A' ' 26' ' ' SER . 63.7 m-85 -163.24 -61.77 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.67 -1.604 . . . . 1.0 109.37 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.829 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -104.07 153.18 21.19 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 109.278 -3.601 . . . . 1.0 108.664 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.569 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -178.14 -60.09 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 115.2 1.556 . . . . 1.0 115.2 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 32' ' ' CYS . 25.7 tptt -70.56 -74.76 0.13 Allowed 'General case' 0 N--CA 1.519 2.983 0 C-N-CA 118.139 -1.425 . . . . 1.0 108.336 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.479 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 23.9 m -59.95 -10.77 4.45 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.201 1.477 . . . . 1.0 110.355 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.829 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m . . . . . 0 C--N 1.293 -1.882 0 CA-C-N 111.86 -2.427 . . . . 1.0 115.682 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.766 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 104.913 -2.255 . . . . 1.0 104.913 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.466 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -158.4 160.03 36.42 Favored 'General case' 0 C--N 1.296 -1.755 0 C-N-CA 119.363 -0.935 . . . . 1.0 110.082 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB3' ' HB3' ' A' ' 22' ' ' LYS . . . -78.23 9.5 3.75 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 106.831 -1.544 . . . . 1.0 106.831 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.562 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -108.03 1.99 22.83 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 104.305 -2.48 . . . . 1.0 104.305 179.468 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.466 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -153.01 -62.9 0.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 115.926 -0.579 . . . . 1.0 112.539 178.437 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 31' ' ' THR . 1.6 t -29.09 -57.99 0.14 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 123.827 1.775 . . . . 1.0 111.806 -179.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -165.93 73.53 0.18 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 109.799 -3.364 . . . . 1.0 109.527 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.562 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.9 m-70 -28.75 -79.03 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 119.685 3.217 . . . . 1.0 119.685 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.97 49.91 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.798 1.777 . . . . 1.0 115.798 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 -1.51 0.42 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.189 -0.945 . . . . 1.0 108.56 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 14' ' ' ALA . 19.7 pttt -58.98 -25.41 63.56 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 117.626 -1.63 . . . . 1.0 111.616 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -86.48 0.51 54.07 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.63 -1.168 . . . . 1.0 108.793 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.6 mtp85 -109.93 -48.62 3.18 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.109 -1.405 . . . . 1.0 110.791 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.527 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -91.92 -69.21 0.75 Allowed 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 103.069 -2.938 . . . . 1.0 103.069 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.416 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 4.0 m 178.92 -49.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 107.039 -1.467 . . . . 1.0 107.039 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.416 ' CG ' ' O ' ' A' ' 26' ' ' SER . 24.6 m-85 -167.03 -84.17 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 105.696 -1.964 . . . . 1.0 105.696 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -81.48 153.16 27.0 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 115.592 -0.731 . . . . 1.0 111.008 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.531 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 tmm_? -171.52 -90.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.551 1.685 . . . . 1.0 115.551 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.403 ' H ' ' HB3' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -33.07 -54.08 0.38 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 117.766 2.506 . . . . 1.0 117.766 -179.78 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.59 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 8.6 m -88.48 -6.21 57.76 Favored 'General case' 0 N--CA 1.514 2.749 0 C-N-CA 125.785 1.634 . . . . 1.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 4.1 m . . . . . 0 C--N 1.287 -2.149 0 CA-C-N 110.817 -2.902 . . . . 1.0 112.182 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.331 0 N-CA-C 107.823 -1.177 . . . . 1.0 107.823 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.505 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -156.06 145.89 21.2 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 116.296 -1.811 . . . . 1.0 108.218 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.429 ' O ' ' HA ' ' A' ' 19' ' ' HIS . . . -62.88 -7.04 4.36 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 117.753 -1.579 . . . . 1.0 107.565 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.528 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 1.0 OUTLIER -87.88 1.7 53.36 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.372 -0.83 . . . . 1.0 109.362 179.652 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.488 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -153.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.191 0.932 . . . . 1.0 110.531 179.343 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -32.79 -42.06 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 114.506 1.299 . . . . 1.0 114.506 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? 179.9 72.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 126.623 2.452 . . . . 1.0 112.141 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.03 -91.67 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.348 2.722 . . . . 1.0 118.348 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 41.19 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.018 1.859 . . . . 1.0 116.018 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -142.42 -1.52 1.16 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.921 -1.14 . . . . 1.0 107.921 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -54.79 -36.82 65.31 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 117.35 -1.74 . . . . 1.0 109.263 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -79.02 2.11 21.62 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.232 -1.349 . . . . 1.0 111.517 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.7 mtp85 -108.5 -40.16 5.2 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.019 -0.991 . . . . 1.0 111.914 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.54 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.05 -79.21 0.42 Allowed 'General case' 0 N--CA 1.483 1.214 1 N-CA-C 96.77 -5.27 . . . . 1.0 96.77 179.078 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -170.02 -51.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.513 1.133 . . . . 1.0 108.006 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -155.43 -71.37 0.12 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.591 -2.095 . . . . 1.0 107.437 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.497 ' SG ' ' C ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -115.07 139.93 49.47 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 111.482 -2.599 . . . . 1.0 108.468 -179.745 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.87 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -151.84 -55.47 0.14 Allowed 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 118.426 2.75 . . . . 1.0 118.426 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.555 ' C ' ' H ' ' A' ' 32' ' ' CYS . 21.7 tptp -66.09 -81.95 0.03 OUTLIER 'General case' 0 N--CA 1.527 3.413 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.609 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.672 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.7 m -62.55 -5.11 2.32 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 124.53 2.11 . . . . 1.0 111.517 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.87 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.28 -2.453 0 CA-C-N 109.444 -3.525 . . . . 1.0 112.04 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 14.5 p . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 123.258 1.504 . . . . 1.0 110.992 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.416 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -57.27 140.61 49.4 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 117.434 -1.706 . . . . 1.0 108.397 -179.504 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -24.19 1.71 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 124.794 1.309 . . . . 1.0 107.95 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.642 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -73.68 9.32 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 120.949 0.404 . . . . 1.0 111.791 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.459 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -152.31 -59.33 0.15 Allowed 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 108.648 -0.871 . . . . 1.0 108.648 178.615 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.9 t -40.98 -48.52 3.2 Favored 'General case' 0 N--CA 1.517 2.908 0 CA-C-O 122.818 1.294 . . . . 1.0 111.972 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.32 71.63 0.08 Allowed 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 112.407 -2.179 . . . . 1.0 114.776 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.6 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -28.76 -60.59 0.13 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.515 -1.22 . . . . 1.0 113.862 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.0 p -88.98 22.56 2.68 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 121.259 3.8 . . . . 1.0 121.259 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -140.88 3.77 1.85 Allowed 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 117.245 -1.782 . . . . 1.0 106.901 178.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.411 ' CG ' ' H ' ' A' ' 23' ' ' TYR . 0.0 OUTLIER -49.98 -55.74 13.44 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 116.169 -2.213 . . . . 1.0 108.423 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.411 ' H ' ' CG ' ' A' ' 22' ' ' LYS . 10.8 p90 -60.78 -13.78 17.34 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 114.284 -1.325 . . . . 1.0 112.694 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -86.71 -42.41 13.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 120.459 -0.496 . . . . 1.0 110.467 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.511 ' HG ' ' CG ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.54 -58.33 2.56 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 103.97 -2.604 . . . . 1.0 103.97 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 178.57 -62.35 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.524 -1.658 . . . . 1.0 106.524 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -150.95 -65.01 0.19 Allowed 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 110.493 -3.048 . . . . 1.0 114.671 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.793 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -101.22 143.52 31.19 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 113.233 -1.803 . . . . 1.0 114.224 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.749 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -167.76 -86.89 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 119.527 3.158 . . . . 1.0 119.527 179.593 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -30.43 0.11 Allowed 'General case' 0 N--CA 1.525 3.32 0 N-CA-C 119.343 3.09 . . . . 1.0 119.343 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 88.4 m -112.59 -7.74 13.86 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.628 1.571 . . . . 1.0 109.758 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 4.3 m . . . . . 0 C--N 1.295 -1.788 0 CA-C-N 111.858 -2.428 . . . . 1.0 113.641 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 100.943 -3.725 . . . . 1.0 100.943 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.59 175.98 7.85 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 113.329 -1.76 . . . . 1.0 110.248 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.473 HD12 ' N ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -111.18 -69.85 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 C-N-CA 120.959 -0.296 . . . . 1.0 111.621 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.509 ' CG ' ' H ' ' A' ' 6' ' ' THR . 35.8 t70 -146.29 -126.03 0.07 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 124.056 0.848 . . . . 1.0 109.594 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.509 ' H ' ' CG ' ' A' ' 5' ' ' ASP . 5.2 t -33.41 -24.84 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 C-N-CA 127.739 2.415 . . . . 1.0 116.013 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.564 ' HB ' ' SG ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER -59.44 163.2 6.91 Favored Pre-proline 0 C--N 1.3 -1.568 0 CA-C-N 115.273 -0.876 . . . . 1.0 113.21 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.542 ' O ' ' N ' ' A' ' 10' ' ' SER . 72.6 Cg_exo -40.34 66.54 0.0 OUTLIER 'Trans proline' 0 N--CA 1.504 2.136 1 C-N-CA 127.078 5.185 . . . . 1.0 115.493 165.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.419 ' N ' ' O ' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -18.8 66.02 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 117.263 2.32 . . . . 1.0 117.263 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 8' ' ' PRO . 97.4 p -144.14 -101.67 0.11 Allowed 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 114.082 -1.417 . . . . 1.0 110.951 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -132.4 24.52 4.46 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 115.48 1.659 . . . . 1.0 115.48 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.828 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.1 p -102.23 138.0 39.75 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 106.951 -1.5 . . . . 1.0 106.951 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -153.61 151.31 29.58 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 117.992 -1.004 . . . . 1.0 110.377 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.46 -11.05 50.13 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.522 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -81.92 2.01 32.58 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.733 -1.21 . . . . 1.0 107.733 179.487 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.47 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -151.5 -66.97 0.18 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.227 0.955 . . . . 1.0 111.986 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.7 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.8 t -29.57 -44.56 0.04 OUTLIER 'General case' 0 N--CA 1.52 3.032 0 CA-C-O 123.229 1.49 . . . . 1.0 112.951 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.21 71.22 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 110.709 -2.951 . . . . 1.0 113.437 -179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.522 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 85.5 m-70 -29.56 -84.44 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 114.841 1.423 . . . . 1.0 114.841 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.83 78.26 2.75 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.727 1.727 . . . . 1.0 110.778 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.72 -12.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 112.367 -2.197 . . . . 1.0 110.035 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -54.34 -20.15 6.75 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 118.066 -1.454 . . . . 1.0 113.512 179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.496 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 29.6 p90 -96.97 5.06 51.16 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 122.105 0.955 . . . . 1.0 109.659 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.496 ' HD3' ' CE1' ' A' ' 23' ' ' TYR . 11.6 mtp85 -109.49 -48.02 3.3 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.946 -1.479 . . . . 1.0 108.14 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.5 ' CG ' ' HD3' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -90.78 -79.06 0.37 Allowed 'General case' 0 N--CA 1.481 1.123 1 N-CA-C 98.769 -4.53 . . . . 1.0 98.769 178.989 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.404 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.7 m 178.71 -43.81 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.824 -1.547 . . . . 1.0 106.824 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -159.77 -64.5 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.529 -1.668 . . . . 1.0 113.959 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -111.53 155.84 22.65 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 112.433 -2.167 . . . . 1.0 111.408 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.7 ttp180 -176.55 -89.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 116.874 2.176 . . . . 1.0 116.874 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -39.9 -42.53 1.35 Allowed 'General case' 0 N--CA 1.521 3.107 0 N-CA-C 116.622 2.082 . . . . 1.0 116.622 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.7 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 6.9 m -105.21 1.33 28.1 Favored 'General case' 0 N--CA 1.513 2.689 0 CA-C-O 124.449 2.071 . . . . 1.0 111.843 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 5.0 m -113.25 -11.87 13.16 Favored 'General case' 0 C--N 1.282 -2.363 0 CA-C-N 109.704 -3.407 . . . . 1.0 115.238 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 41.53 21.44 0.06 OUTLIER Glycine 0 N--CA 1.502 3.046 0 CA-C-N 118.418 0.554 . . . . 1.0 113.251 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.2 t -99.0 -37.81 9.23 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 117.736 2.495 . . . . 1.0 117.736 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.494 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 117.943 -1.027 . . . . 1.0 110.033 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.0 t -121.31 -165.49 1.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 118.491 -1.284 . . . . 1.0 108.808 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.542 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -111.39 -120.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 104.579 -2.378 . . . . 1.0 104.579 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.42 ' N ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -100.58 37.1 1.76 Allowed 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 115.13 -0.941 . . . . 1.0 110.935 -179.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.546 HG23 ' SG ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER -94.15 154.95 17.32 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.458 0.647 . . . . 1.0 110.662 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -59.87 -52.68 71.95 Favored Pre-proline 0 N--CA 1.501 2.079 0 CA-C-N 115.13 -0.941 . . . . 1.0 112.826 -179.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.641 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 10.2 Cg_endo -57.48 83.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.487 1.134 0 C-N-CA 122.786 2.324 . . . . 1.0 107.941 165.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.62 54.77 1.24 Allowed 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 112.934 -1.939 . . . . 1.0 110.336 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -121.39 -123.1 0.28 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.083 -2.326 . . . . 1.0 106.486 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.6 78.45 1.79 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.729 -1.952 . . . . 1.0 105.729 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.78 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -135.82 129.13 31.98 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 102.41 -3.181 . . . . 1.0 102.41 179.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.459 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -148.92 153.27 37.76 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 113.394 -1.73 . . . . 1.0 109.252 -179.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.72 10.22 4.29 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 105.414 -2.069 . . . . 1.0 105.414 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.558 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -101.95 -0.54 33.66 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 105.233 -2.136 . . . . 1.0 105.233 179.559 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.447 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -158.3 -52.03 0.07 Allowed 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.652 0.612 . . . . 1.0 112.652 178.674 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.0 t -29.86 -55.74 0.17 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 124.952 1.407 . . . . 1.0 110.687 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -168.61 77.87 0.13 Allowed 'General case' 0 N--CA 1.488 1.454 1 O-C-N 129.389 4.18 . . . . 1.0 109.892 -179.607 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.544 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -29.92 -87.84 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.971 2.212 . . . . 1.0 116.971 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.24 77.0 0.25 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 123.245 1.498 . . . . 1.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.8 -12.8 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.274 -1.785 . . . . 1.0 109.066 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.9 pttt -55.51 -19.69 10.54 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.163 -1.415 . . . . 1.0 111.725 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -95.97 11.47 33.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.415 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -120.4 -47.32 2.35 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 113.78 -1.555 . . . . 1.0 109.054 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -91.5 -74.07 0.52 Allowed 'General case' 0 C--N 1.312 -1.026 1 N-CA-C 99.311 -4.329 . . . . 1.0 99.311 179.09 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.4 ' H ' HD21 ' A' ' 25' ' ' LEU . 1.6 m 178.01 -50.85 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 123.702 1.715 . . . . 1.0 107.777 179.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -161.08 -63.28 0.06 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.296 -3.138 . . . . 1.0 111.901 -178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.768 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 m -109.82 137.2 47.95 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 113.578 -1.646 . . . . 1.0 114.0 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.533 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 10.1 ttp180 -166.91 -56.4 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 N-CA-C 116.879 2.177 . . . . 1.0 116.879 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.404 ' C ' ' H ' ' A' ' 32' ' ' CYS . 70.0 tttt -66.25 -79.22 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.62 0 C-N-CA 117.323 -1.751 . . . . 1.0 108.285 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.597 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 59.5 m -59.21 -12.55 5.5 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-O 122.428 1.109 . . . . 1.0 110.257 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.78 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 1.7 m -98.06 -14.85 20.28 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 117.73 2.492 . . . . 1.0 117.73 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 34.53 27.9 0.01 OUTLIER Glycine 0 N--CA 1.504 3.208 0 O-C-N 124.228 0.955 . . . . 1.0 113.53 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.506 ' CG2' ' H ' ' A' ' 35' ' ' ABA . 15.0 t -100.83 -75.04 0.59 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 117.393 2.368 . . . . 1.0 117.393 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.506 ' H ' ' CG2' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 112.691 0.626 . . . . 1.0 112.691 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.75 172.35 12.09 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 106.026 -1.842 . . . . 1.0 106.026 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.406 ' HA ' ' O ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.636 ' CD1' ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -113.3 -92.45 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 CA-C-O 117.83 -1.081 . . . . 1.0 112.266 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.636 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 12.3 t70 -120.19 -105.58 0.38 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 115.594 1.701 . . . . 1.0 115.594 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.76 1.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 116.416 2.006 . . . . 1.0 116.416 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.626 ' HB ' ' SG ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -81.66 171.56 11.79 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 108.289 -1.004 . . . . 1.0 108.289 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' HD2' ' SG ' ' A' ' 12' ' ' CYS . 11.5 Cg_endo -56.75 119.31 6.46 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 106.502 -2.153 . . . . 1.0 106.502 168.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -68.55 73.02 0.23 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 123.194 1.473 . . . . 1.0 108.911 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.0 m -147.79 -109.52 0.08 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.488 -1.233 . . . . 1.0 110.236 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.96 37.14 4.2 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 116.422 2.008 . . . . 1.0 116.422 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER -119.65 132.69 55.75 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 105.13 -2.174 . . . . 1.0 105.13 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.474 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -147.97 150.33 33.82 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 117.495 -1.241 . . . . 1.0 109.997 -179.597 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.82 -10.84 41.4 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 105.758 -1.942 . . . . 1.0 105.758 179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.474 ' CD2' ' OG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -81.9 1.7 33.94 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.433 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.406 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -157.34 -60.28 0.09 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.328 1.018 . . . . 1.0 112.432 179.254 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.747 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.7 t -30.61 -45.21 0.06 Allowed 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.05 75.21 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 127.86 3.225 . . . . 1.0 113.772 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.459 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 73.8 m-70 -28.8 -94.21 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 118.601 2.815 . . . . 1.0 118.601 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.17 34.71 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.847 1.425 . . . . 1.0 114.847 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 22' ' ' LYS . . . -139.12 0.93 1.98 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 117.857 -1.068 . . . . 1.0 108.318 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.418 ' HG3' ' N ' ' A' ' 23' ' ' TYR . 15.6 pttp -50.08 -52.34 35.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 116.511 -2.075 . . . . 1.0 108.074 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.418 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 25.3 p90 -62.83 -8.89 7.77 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 114.338 -1.301 . . . . 1.0 112.305 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 mtp85 -97.39 -36.92 10.21 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 118.163 -0.922 . . . . 1.0 110.752 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.525 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -102.03 -58.1 1.94 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.067 -2.197 . . . . 1.0 105.067 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 177.85 -67.56 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 124.44 2.067 . . . . 1.0 106.115 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -157.09 -52.11 0.07 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 108.47 -3.968 . . . . 1.0 112.866 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.778 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -117.93 151.01 38.27 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.383 -1.281 . . . . 1.0 109.143 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.525 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.2 tmm_? -167.75 -88.54 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 117.796 2.517 . . . . 1.0 117.796 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' HE3' ' OG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -49.96 -22.85 1.7 Allowed 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 117.631 2.456 . . . . 1.0 117.631 -179.316 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.747 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 5.3 m -114.51 -0.49 13.7 Favored 'General case' 0 N--CA 1.513 2.683 0 CA-C-O 124.574 2.13 . . . . 1.0 110.253 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 12' ' ' CYS 0.267 15.5 m -110.39 176.61 4.98 Favored 'General case' 0 C--N 1.285 -2.204 0 CA-C-N 108.87 -3.786 . . . . 1.0 108.956 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.16 34.13 2.49 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 106.393 -2.683 . . . . 1.0 106.393 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.27 -78.41 0.54 Allowed 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 117.287 2.329 . . . . 1.0 117.287 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.463 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 104.913 -2.254 . . . . 1.0 104.913 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.79 -150.53 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 124.964 1.415 . . . . 1.0 110.932 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.677 ' CD1' ' H ' ' A' ' 5' ' ' ASP 0.295 0.0 OUTLIER -114.65 -120.96 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 N-CA-C 102.113 -3.292 . . . . 1.0 102.113 -179.757 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.677 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 0.3 OUTLIER -139.0 65.39 1.45 Allowed 'General case' 0 C--N 1.298 -1.656 0 CA-C-O 123.292 1.52 . . . . 1.0 110.946 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.48 HG22 ' SG ' ' A' ' 28' ' ' CYS . 0.1 OUTLIER -100.8 -121.78 0.16 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 102.933 -2.988 . . . . 1.0 102.933 179.555 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.2 mt -111.89 -64.26 0.03 OUTLIER Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 109.252 -0.647 . . . . 1.0 109.252 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.666 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 60.9 Cg_endo -74.27 95.36 0.92 Allowed 'Trans proline' 0 C--N 1.31 -1.449 0 N-CA-C 106.374 -2.202 . . . . 1.0 106.374 -176.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.467 ' NZ ' ' CG ' ' A' ' 5' ' ' ASP . 17.1 tttp -78.41 66.46 3.97 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 123.148 1.452 . . . . 1.0 109.564 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 43.9 m -119.88 -107.87 0.36 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 111.415 -2.629 . . . . 1.0 103.943 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.34 78.48 1.58 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.674 -1.973 . . . . 1.0 105.674 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.773 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -145.02 137.09 25.81 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 104.114 -2.55 . . . . 1.0 104.114 179.357 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.424 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -158.82 158.0 32.67 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 105.426 -2.064 . . . . 1.0 105.426 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.76 -1.71 26.34 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 105.532 -2.025 . . . . 1.0 105.532 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.535 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -90.86 2.42 56.16 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 105.867 -1.901 . . . . 1.0 105.867 179.519 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -154.92 -60.81 0.12 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 112.313 0.486 . . . . 1.0 112.313 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.553 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.7 t -31.1 -53.29 0.2 Allowed 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 123.855 1.788 . . . . 1.0 110.33 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.87 71.06 0.14 Allowed 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 111.347 -2.66 . . . . 1.0 113.547 -179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.535 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.76 -79.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.983 1.105 . . . . 1.0 113.983 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.46 71.6 1.82 Allowed 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 123.981 1.848 . . . . 1.0 113.226 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.48 -10.81 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 112.27 -2.241 . . . . 1.0 109.68 179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.3 pttt -55.91 -19.26 11.38 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 116.614 -2.034 . . . . 1.0 113.099 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -94.3 2.58 55.84 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 122.083 0.944 . . . . 1.0 110.245 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -109.46 -46.59 3.52 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 113.462 -1.699 . . . . 1.0 112.341 179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.469 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.54 -72.19 0.58 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 101.455 -3.535 . . . . 1.0 101.455 179.625 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.7 m 179.58 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.022 -1.473 . . . . 1.0 107.022 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -162.61 -58.64 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 113.241 -1.8 . . . . 1.0 111.302 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.761 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.08 155.41 23.9 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.209 -1.359 . . . . 1.0 109.927 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.566 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 9.5 ttp85 -177.83 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 O-C-N 125.095 1.497 . . . . 1.0 113.539 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -35.65 -44.47 0.32 Allowed 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 119.958 3.318 . . . . 1.0 119.958 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.553 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 24.8 m -101.26 -5.72 25.13 Favored 'General case' 0 N--CA 1.508 2.44 0 CA-C-O 123.454 1.597 . . . . 1.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.773 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 6.7 m -98.88 158.78 15.41 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 110.652 -2.976 . . . . 1.0 115.193 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.06 41.74 2.13 Favored Glycine 0 N--CA 1.492 2.429 0 CA-C-N 111.745 -2.479 . . . . 1.0 110.547 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.33 -79.63 0.58 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 113.807 -1.197 . . . . 1.0 109.351 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 . . . . . 0 N--CA 1.505 2.296 0 N-CA-C 101.474 -3.528 . . . . 1.0 101.474 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.61 179.52 6.37 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 113.099 -1.864 . . . . 1.0 107.539 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.581 ' CD1' ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -108.92 -89.38 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 106.19 -1.781 . . . . 1.0 106.19 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.581 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 14.9 t70 -147.16 -87.08 0.09 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.813 1.32 . . . . 1.0 109.703 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -18.01 -103.08 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 119.883 3.29 . . . . 1.0 119.883 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.5 pt -128.58 48.28 3.45 Favored Pre-proline 0 N--CA 1.51 2.574 0 CA-C-N 121.602 2.001 . . . . 1.0 114.066 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.465 ' C ' ' H ' ' A' ' 10' ' ' SER . 69.7 Cg_endo -82.28 89.16 1.21 Allowed 'Trans proline' 0 C--N 1.306 -1.68 0 C-N-CA 122.749 2.299 . . . . 1.0 110.02 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -71.04 30.63 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 119.066 -1.053 . . . . 1.0 113.252 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.465 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER 179.97 -110.54 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 C-N-CA 123.427 0.691 . . . . 1.0 109.411 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -131.1 57.53 1.75 Allowed 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.873 -0.517 . . . . 1.0 111.136 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -109.91 132.4 54.19 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.135 -2.172 . . . . 1.0 105.135 179.537 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.408 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -147.66 163.37 36.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 179.59 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.92 -1.62 40.14 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 106.111 -1.811 . . . . 1.0 106.111 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.528 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -90.51 1.18 56.95 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 104.609 -2.367 . . . . 1.0 104.609 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.436 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -152.59 -61.34 0.15 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.0 t -29.97 -52.21 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 123.947 1.832 . . . . 1.0 110.303 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -168.9 79.31 0.13 Allowed 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 110.941 -2.845 . . . . 1.0 112.463 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.93 -78.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.782 1.771 . . . . 1.0 115.782 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.17 40.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 118.625 2.824 . . . . 1.0 118.625 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.437 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -148.48 2.18 0.63 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.349 -1.47 . . . . 1.0 108.388 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.2 pttm -59.32 -28.96 67.28 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 116.881 -1.928 . . . . 1.0 108.35 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.5 p90 -87.22 9.01 21.52 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 113.82 -1.536 . . . . 1.0 110.282 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.437 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 4.0 mtp85 -114.62 -49.69 2.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.453 -1.249 . . . . 1.0 110.884 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -91.77 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 103.434 -2.802 . . . . 1.0 103.434 179.407 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.495 ' H ' HD23 ' A' ' 25' ' ' LEU . 27.7 m 179.75 -51.91 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 105.431 -2.063 . . . . 1.0 105.431 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -160.33 -66.12 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.783 -2.008 . . . . 1.0 109.33 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.807 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -103.11 156.96 17.32 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 111.764 -2.471 . . . . 1.0 111.987 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.505 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 ttm180 179.03 -88.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 115.045 1.498 . . . . 1.0 115.045 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.29 -38.91 1.26 Allowed 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 118.412 2.745 . . . . 1.0 118.412 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 32.1 m -104.41 -5.0 22.1 Favored 'General case' 0 N--CA 1.508 2.425 0 CA-C-O 122.693 1.235 . . . . 1.0 108.025 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 23.7 m -97.35 164.78 12.32 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 112.411 -2.177 . . . . 1.0 116.279 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.34 41.24 2.28 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 108.136 -1.986 . . . . 1.0 108.136 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.547 ' CG2' ' H ' ' A' ' 35' ' ' ABA . 2.2 t -109.77 -81.74 0.57 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 113.817 -1.192 . . . . 1.0 112.719 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.547 ' H ' ' CG2' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.418 ' HA ' ' NH2' ' A' ' 11' ' ' ARG . 1.3 m 179.61 -157.49 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 104.509 -2.404 . . . . 1.0 104.509 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.444 ' CG ' ' H ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.472 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -109.41 -123.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 N-CA-C 107.576 -1.268 . . . . 1.0 107.576 179.635 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.451 ' H ' ' CG1' ' A' ' 4' ' ' ILE . 29.0 p-10 -105.61 39.24 1.8 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 124.611 1.194 . . . . 1.0 111.919 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.422 HG23 ' SG ' ' A' ' 28' ' ' CYS . 1.7 p -95.77 -153.42 0.4 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.503 -0.748 . . . . 1.0 111.109 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -101.92 -48.05 0.18 Allowed Pre-proline 0 N--CA 1.505 2.324 0 CA-C-O 119.167 -0.444 . . . . 1.0 111.928 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -74.61 130.24 13.51 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 N-CA-C 107.465 -1.783 . . . . 1.0 107.465 165.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.7 pttm -100.67 47.42 0.92 Allowed 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.392 -2.185 . . . . 1.0 107.162 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 m -104.47 -111.6 0.25 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.112 -1.403 . . . . 1.0 108.649 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.418 ' NH2' ' HA ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -146.34 69.8 1.21 Allowed 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 105.963 -1.865 . . . . 1.0 105.963 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.763 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -126.86 121.91 33.17 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 105.211 -2.144 . . . . 1.0 105.211 -179.526 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.472 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -148.3 163.59 36.6 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 105.338 -2.097 . . . . 1.0 105.338 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.24 1.96 19.86 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 116.988 -1.885 . . . . 1.0 106.088 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -98.72 1.94 46.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 105.938 -1.875 . . . . 1.0 105.938 179.528 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.45 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -150.74 -62.85 0.19 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 123.516 0.51 . . . . 1.0 109.815 178.12 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.711 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -37.79 -51.3 1.27 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 125.075 1.484 . . . . 1.0 111.301 -179.748 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -163.88 68.57 0.18 Allowed 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 116.012 -2.275 . . . . 1.0 114.122 -179.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.556 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 90.4 m-70 -28.38 -85.16 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 125.034 1.459 . . . . 1.0 114.797 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.465 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.39 46.65 0.27 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 114.375 1.25 . . . . 1.0 114.375 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.524 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . . . -158.48 -0.32 0.09 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.792 -1.549 . . . . 1.0 107.943 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -56.0 -21.9 23.88 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 116.7 -2.0 . . . . 1.0 111.628 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.58 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 6.6 p90 -94.68 4.0 54.37 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 124.281 0.988 . . . . 1.0 110.662 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.58 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.5 tpp180 -100.76 -49.81 4.05 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.672 -0.862 . . . . 1.0 108.672 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.512 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -86.33 -68.87 0.71 Allowed 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 106.654 -1.61 . . . . 1.0 106.654 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.3 m 178.98 -49.83 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 105.19 -2.152 . . . . 1.0 105.19 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -167.27 -50.47 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 109.513 -3.494 . . . . 1.0 109.989 -179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.81 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -116.95 144.31 44.7 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 117.212 2.301 . . . . 1.0 117.212 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.545 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.3 ttm180 -170.11 -84.99 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 118.271 2.693 . . . . 1.0 118.271 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.3 mmtm -43.94 -23.83 0.11 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 119.425 3.12 . . . . 1.0 119.425 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.711 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 97.0 m -116.91 -8.66 11.27 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 123.795 1.759 . . . . 1.0 108.382 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.81 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 4.4 m -100.42 166.07 11.13 Favored 'General case' 0 C--N 1.288 -2.066 0 CA-C-N 112.104 -2.316 . . . . 1.0 114.621 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -113.13 40.63 2.46 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 105.456 -3.058 . . . . 1.0 105.456 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 p -95.37 -80.52 0.42 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.83 0.824 . . . . 1.0 111.643 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.205 1 N-CA-C 99.042 -4.429 . . . . 1.0 99.042 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -169.6 2.36 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 118.56 -1.256 . . . . 1.0 110.749 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.482 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -105.88 -119.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 105.094 -2.187 . . . . 1.0 105.094 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.424 ' H ' ' CG1' ' A' ' 4' ' ' ILE . 3.6 m-20 -91.75 27.82 1.96 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 124.098 0.874 . . . . 1.0 111.604 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.442 ' HB ' ' SG ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -81.88 156.98 24.54 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 100.452 -3.907 . . . . 1.0 100.452 179.417 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -43.24 96.04 Favored Pre-proline 0 N--CA 1.513 2.681 0 N-CA-C 117.446 2.387 . . . . 1.0 117.446 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.54 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 89.7 Cg_endo -75.29 108.87 2.81 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 N-CA-C 106.847 -2.02 . . . . 1.0 106.847 -175.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tttm -78.17 75.61 4.69 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 117.606 -1.638 . . . . 1.0 110.972 -179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -144.76 -102.56 0.11 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.911 -0.586 . . . . 1.0 109.963 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.1 64.54 1.38 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.52 1.152 . . . . 1.0 110.813 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.777 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -131.52 122.02 25.44 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 113.27 -1.786 . . . . 1.0 107.662 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.478 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -146.93 155.34 42.21 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 103.12 -2.918 . . . . 1.0 103.12 179.56 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.7 11.11 3.37 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 116.518 -2.073 . . . . 1.0 105.506 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.525 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -100.76 1.78 40.65 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.786 -1.931 . . . . 1.0 105.786 179.572 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.4 ' O ' ' C ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -155.28 -59.85 0.11 Allowed 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.938 -0.705 . . . . 1.0 110.714 178.568 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.777 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -34.86 -57.82 0.53 Allowed 'General case' 0 N--CA 1.485 1.282 0 O-C-N 125.21 1.569 . . . . 1.0 110.453 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.475 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -162.5 72.06 0.33 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 112.396 -2.184 . . . . 1.0 113.022 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.502 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.51 -75.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 115.649 1.722 . . . . 1.0 115.649 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.35 44.16 0.25 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 115.342 1.608 . . . . 1.0 115.342 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.545 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -146.32 4.06 0.91 Allowed 'General case' 0 C--N 1.299 -1.627 0 C-N-CA 118.62 -1.232 . . . . 1.0 109.242 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 pttm -62.81 -21.81 66.18 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 115.441 -2.504 . . . . 1.0 106.45 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -97.7 10.81 39.06 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.156 -1.384 . . . . 1.0 110.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.545 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -105.49 -51.28 3.04 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.104 -1.073 . . . . 1.0 108.104 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.488 ' CD2' ' H ' ' A' ' 26' ' ' SER . 0.0 OUTLIER -98.04 -99.8 0.21 Allowed 'General case' 0 C--N 1.306 -1.288 1 N-CA-C 97.792 -4.892 . . . . 1.0 97.792 179.31 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.488 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 71.1 m -139.82 -47.54 0.45 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 106.433 -1.692 . . . . 1.0 106.433 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -152.81 -61.86 0.15 Allowed 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.018 -1.901 . . . . 1.0 109.152 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.449 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.3 m -112.07 147.51 35.87 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 117.444 2.387 . . . . 1.0 117.444 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.836 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -151.77 -86.85 0.07 Allowed 'General case' 0 CA--C 1.571 1.778 0 CA-C-N 113.183 -1.826 . . . . 1.0 112.099 178.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.438 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 7.6 tptp -31.0 -53.42 0.2 Allowed 'General case' 0 N--CA 1.513 2.709 1 N-CA-C 124.131 4.863 . . . . 1.0 124.131 -179.635 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.625 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 3.5 m -113.26 4.98 16.72 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-O 125.505 2.574 . . . . 1.0 112.405 -179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.836 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -90.18 164.07 14.57 Favored 'General case' 0 C--N 1.278 -2.51 1 CA-C-N 107.977 -4.192 . . . . 1.0 112.703 -179.877 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -122.68 35.55 3.4 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 108.399 -1.88 . . . . 1.0 108.399 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.96 -91.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 103.802 -2.666 . . . . 1.0 103.802 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.83 0 N-CA-C 107.655 -1.239 . . . . 1.0 107.655 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -151.82 -151.22 0.38 Allowed 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.644 ' CD1' ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -115.97 -96.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.644 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 3.1 t70 -132.74 -92.84 0.36 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.452 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 26.1 p -18.96 -96.9 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.966 3.321 . . . . 1.0 119.966 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.467 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.3 pt -127.4 41.54 0.72 Allowed Pre-proline 0 N--CA 1.508 2.431 0 N-CA-C 116.712 2.115 . . . . 1.0 116.712 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.467 ' CD ' ' N ' ' A' ' 7' ' ' ILE . 88.0 Cg_endo -78.29 104.34 1.82 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 124.48 3.453 . . . . 1.0 106.933 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -90.31 8.73 31.89 Favored 'General case' 0 N--CA 1.503 2.193 0 CA-C-O 123.166 1.46 . . . . 1.0 113.023 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.6 m -153.08 -110.42 0.04 OUTLIER 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 112.487 -2.142 . . . . 1.0 107.662 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' NH1' ' O ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -134.97 77.25 1.67 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 104.997 -2.223 . . . . 1.0 104.997 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.72 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -121.88 130.08 53.08 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 104.12 -2.548 . . . . 1.0 104.12 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.428 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -150.56 160.29 43.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.679 -0.859 . . . . 1.0 108.679 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.96 5.8 13.0 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 106.886 -1.524 . . . . 1.0 106.886 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.509 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -101.77 2.19 38.14 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.144 -2.169 . . . . 1.0 105.144 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -157.79 -52.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 114.739 1.385 . . . . 1.0 114.739 178.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.4 t -29.3 -49.69 0.09 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 124.833 1.333 . . . . 1.0 111.442 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.484 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 2.0 tppt? -178.33 82.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 110.781 -2.918 . . . . 1.0 108.521 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.509 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.3 m-70 -32.0 -84.8 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 115.992 1.849 . . . . 1.0 115.992 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -61.95 30.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 118.142 2.645 . . . . 1.0 118.142 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.484 ' CB ' ' HG3' ' A' ' 18' ' ' LYS . . . -146.89 4.24 0.84 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.948 -1.871 . . . . 1.0 105.948 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -56.35 -30.79 63.08 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 117.023 -1.871 . . . . 1.0 107.079 179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.574 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 25.5 p90 -85.69 6.39 27.86 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 115.588 -0.733 . . . . 1.0 112.573 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.574 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.3 tpp180 -103.1 -47.61 4.29 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.756 -1.572 . . . . 1.0 106.756 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.486 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.6 -71.79 0.61 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 101.527 -3.508 . . . . 1.0 101.527 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m 178.63 -47.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 106.192 -1.781 . . . . 1.0 106.192 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -158.94 -65.66 0.08 Allowed 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 111.969 -2.378 . . . . 1.0 109.201 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.797 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.5 m -111.24 143.22 42.36 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 110.199 -3.182 . . . . 1.0 112.943 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.57 ' HG3' ' C ' ' A' ' 35' ' ' ABA . 0.8 OUTLIER 179.71 -34.71 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.173 2.286 . . . . 1.0 117.173 179.207 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 1.4 tmtp? -83.96 -53.86 5.27 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 122.245 2.293 . . . . 1.0 109.519 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.6 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 90.2 m -84.41 -4.34 58.85 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 105.004 -2.221 . . . . 1.0 105.004 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.797 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.5 m -98.16 -67.03 0.87 Allowed 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 112.127 -2.306 . . . . 1.0 115.368 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.57 9.93 64.07 Favored Glycine 0 N--CA 1.504 3.193 0 N-CA-C 107.921 -2.072 . . . . 1.0 107.921 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 p -70.6 -84.39 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 113.196 -1.502 . . . . 1.0 113.085 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.57 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 25.8 mtp180 . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 101.469 -3.53 . . . . 1.0 101.469 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -161.14 114.39 1.96 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.419 HD12 ' N ' ' A' ' 5' ' ' ASP . 0.1 OUTLIER -113.46 -48.85 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.222 -1.029 . . . . 1.0 108.222 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 4' ' ' ILE . 4.6 t70 -120.24 -89.6 0.6 Allowed 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 113.714 -1.585 . . . . 1.0 107.863 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.86 177.58 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 123.787 1.756 . . . . 1.0 115.554 179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.0 pt -121.07 77.76 32.26 Favored Pre-proline 0 N--CA 1.501 2.083 0 CA-C-N 113.1 -1.864 . . . . 1.0 113.603 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.59 ' HG3' ' SG ' ' A' ' 12' ' ' CYS . 11.5 Cg_endo -86.79 174.92 5.39 Favored 'Trans proline' 0 C--N 1.307 -1.632 1 C-N-CA 125.781 4.321 . . . . 1.0 108.948 168.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -88.08 25.2 1.64 Allowed 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.122 -1.031 . . . . 1.0 111.43 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -174.76 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 N-CA-C 117.689 2.477 . . . . 1.0 117.689 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.07 62.09 1.43 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.43 1.27 . . . . 1.0 114.43 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -96.87 122.35 39.73 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 116.976 -1.89 . . . . 1.0 106.925 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.426 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -135.08 161.2 35.98 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 103.478 -2.786 . . . . 1.0 103.478 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.96 0.26 21.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 104.872 -2.27 . . . . 1.0 104.872 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.59 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -94.52 4.0 54.41 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.924 -1.509 . . . . 1.0 106.924 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.426 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.14 -60.05 0.16 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.084 -0.962 . . . . 1.0 112.589 178.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.543 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.8 t -30.92 -47.49 0.1 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -173.89 74.34 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 109.861 -3.336 . . . . 1.0 112.263 -179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.59 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.6 m-70 -29.45 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 116.734 2.124 . . . . 1.0 116.734 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.35 41.29 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.759 2.503 . . . . 1.0 117.759 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -146.92 0.87 0.75 Allowed 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 107.993 -1.114 . . . . 1.0 107.993 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 36.5 pttt -58.16 -28.55 64.84 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 116.184 -2.206 . . . . 1.0 109.585 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -84.57 2.98 38.83 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.902 -1.044 . . . . 1.0 110.189 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -110.27 -47.56 3.28 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 113.878 -1.51 . . . . 1.0 112.519 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.537 ' HG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.9 -65.49 0.98 Allowed 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 103.552 -2.759 . . . . 1.0 103.552 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.484 ' H ' HD21 ' A' ' 25' ' ' LEU . 0.4 OUTLIER 178.73 -55.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 105.171 -2.159 . . . . 1.0 105.171 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -157.18 -63.22 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 111.028 -2.806 . . . . 1.0 109.395 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.788 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -102.59 162.12 13.18 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 112.194 -2.276 . . . . 1.0 112.044 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.537 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 8.2 ttp85 177.59 -92.51 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 125.311 1.444 . . . . 1.0 111.897 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.92 -50.85 0.22 Allowed 'General case' 0 N--CA 1.51 2.572 0 N-CA-C 117.945 2.572 . . . . 1.0 117.945 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.543 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 7.5 m -97.56 -2.32 41.99 Favored 'General case' 0 N--CA 1.514 2.754 0 CA-C-N 113.842 -1.526 . . . . 1.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 30.1 m -100.6 -53.29 3.12 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 110.8 -2.909 . . . . 1.0 115.833 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.51 -7.62 79.76 Favored Glycine 0 N--CA 1.498 2.789 0 C-N-CA 119.946 -1.121 . . . . 1.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -65.03 -45.35 85.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 105.741 -1.948 . . . . 1.0 105.741 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.456 ' C ' ' CG ' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.433 ' N ' ' OE1' ' A' ' 16' ' ' GLN . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 108.158 -1.053 . . . . 1.0 108.158 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -105.34 -154.54 0.51 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 103.584 -2.747 . . . . 1.0 103.584 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.514 ' CD1' ' N ' ' A' ' 5' ' ' ASP 0.317 0.0 OUTLIER -119.88 -86.8 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 118.632 0.651 . . . . 1.0 112.172 -179.537 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.514 ' N ' ' CD1' ' A' ' 4' ' ' ILE . 10.9 t70 -118.05 -98.19 0.45 Allowed 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.072 0.949 . . . . 1.0 113.459 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' A' ' 7' ' ' ILE . 0.4 OUTLIER -18.4 -102.91 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 116.113 1.894 . . . . 1.0 116.113 -179.354 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.486 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pp -145.1 26.19 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.267 0 CA-C-N 121.366 1.893 . . . . 1.0 115.553 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.765 ' CB ' ' SG ' ' A' ' 12' ' ' CYS . 19.2 Cg_endo -75.47 109.19 2.86 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 CA-C-N 120.391 1.176 . . . . 1.0 110.774 -168.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -81.68 51.79 1.77 Allowed 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.233 -0.894 . . . . 1.0 109.341 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -156.03 -138.23 0.07 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.136 -0.938 . . . . 1.0 111.516 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.06 39.96 3.85 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.734 -1.121 . . . . 1.0 108.428 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.765 ' SG ' ' CB ' ' A' ' 8' ' ' PRO . 3.3 p -96.75 139.58 32.59 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 103.765 -2.68 . . . . 1.0 103.765 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.445 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -151.13 159.67 44.32 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.47 1.85 15.36 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 105.265 -2.124 . . . . 1.0 105.265 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -96.63 1.67 51.41 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 105.103 -2.184 . . . . 1.0 105.103 179.337 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -61.1 0.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.078 0.77 . . . . 1.0 113.078 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.7 t -29.4 -54.39 0.14 Allowed 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 124.324 2.012 . . . . 1.0 111.583 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.21 75.09 0.15 Allowed 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 110.484 -3.053 . . . . 1.0 111.093 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.6 m-70 -29.19 -79.66 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.124 1.898 . . . . 1.0 116.124 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.21 36.7 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 119.221 3.045 . . . . 1.0 119.221 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -144.93 1.15 0.98 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.588 -1.245 . . . . 1.0 108.118 179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.2 pttp -58.36 -32.78 68.87 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 116.837 -1.945 . . . . 1.0 110.76 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -80.17 0.52 31.96 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.755 -1.566 . . . . 1.0 109.824 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -111.74 -46.37 3.25 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 114.903 1.446 . . . . 1.0 114.903 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.517 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.77 -67.74 0.82 Allowed 'General case' 0 N--CA 1.483 1.196 1 N-CA-C 99.789 -4.152 . . . . 1.0 99.789 179.597 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.439 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.6 m 178.38 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.563 -1.643 . . . . 1.0 106.563 179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -161.0 -62.37 0.06 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 113.317 -1.765 . . . . 1.0 111.16 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.798 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.53 136.19 52.34 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 111.924 -2.398 . . . . 1.0 110.647 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.517 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -164.75 -50.08 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 116.015 1.857 . . . . 1.0 116.015 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.479 ' C ' ' H ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -66.1 -83.54 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.932 -1.107 . . . . 1.0 108.058 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.571 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 14.8 m -59.25 -9.43 2.19 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 122.964 1.364 . . . . 1.0 110.571 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.798 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m -94.04 -29.53 15.16 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 112.078 -2.328 . . . . 1.0 116.318 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 49.88 22.76 4.68 Favored Glycine 0 N--CA 1.496 2.648 0 O-C-N 124.354 1.034 . . . . 1.0 111.275 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.406 ' OG1' ' HA ' ' A' ' 29' ' ' ARG . 3.8 p -77.01 -73.79 0.28 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 116.243 1.942 . . . . 1.0 116.243 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.463 ' C ' ' HD3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 108.071 -1.085 . . . . 1.0 108.071 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.414 ' OG ' ' N ' ' A' ' 3' ' ' ABA . 26.3 t 179.87 -172.36 0.19 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 104.762 -2.31 . . . . 1.0 104.762 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.414 ' N ' ' OG ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.484 HD12 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -118.72 -86.18 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-O 118.2 -0.905 . . . . 1.0 112.595 179.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.484 ' H ' HD12 ' A' ' 4' ' ' ILE . 21.0 t70 -118.28 -100.59 0.44 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 115.912 1.819 . . . . 1.0 115.912 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -14.11 62.66 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 115.601 1.704 . . . . 1.0 115.601 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.678 ' HB ' ' SG ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -59.62 164.64 5.21 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 121.454 0.645 . . . . 1.0 112.17 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.578 ' O ' ' N ' ' A' ' 10' ' ' SER . 10.1 Cg_endo -56.31 80.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.313 -1.333 0 C-N-CA 124.262 3.308 . . . . 1.0 111.286 169.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -30.45 67.14 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.449 0 N-CA-C 116.08 1.882 . . . . 1.0 116.08 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 8' ' ' PRO . 48.2 m -147.21 -88.74 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.032 1.123 . . . . 1.0 114.032 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -135.2 40.81 2.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 115.274 1.583 . . . . 1.0 115.274 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.771 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -129.32 137.33 50.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 102.975 -2.972 . . . . 1.0 102.975 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.479 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -159.64 138.45 10.8 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 116.058 -1.925 . . . . 1.0 109.109 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.39 -12.32 1.62 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 117.907 -1.517 . . . . 1.0 108.193 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.509 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -83.15 4.43 26.59 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.24 -0.913 . . . . 1.0 111.129 179.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.58 -61.0 0.1 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.597 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.772 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.1 OUTLIER -36.29 -46.14 0.51 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 113.972 -1.467 . . . . 1.0 113.832 -179.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.3 70.47 0.06 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.536 -2.575 . . . . 1.0 113.083 -179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 81.8 m-70 -28.61 -92.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 117.508 2.41 . . . . 1.0 117.508 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.464 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.81 56.92 0.75 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.289 -0.869 . . . . 1.0 113.266 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -156.36 -9.52 0.1 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.973 -1.467 . . . . 1.0 108.591 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 pttt -54.5 -22.46 12.98 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 118.321 -1.352 . . . . 1.0 111.131 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.513 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 27.7 p90 -93.94 8.01 42.92 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.882 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.513 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.1 tpp180 -108.4 -48.37 3.35 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 106.233 -1.765 . . . . 1.0 106.233 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.439 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -93.19 -77.81 0.44 Allowed 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 101.825 -3.398 . . . . 1.0 101.825 179.368 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER 178.99 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.9 -1.519 . . . . 1.0 106.9 179.581 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.413 ' CG ' ' O ' ' A' ' 26' ' ' SER . 50.6 m-85 -163.43 -59.45 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 111.62 -2.536 . . . . 1.0 112.04 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.499 ' SG ' ' C ' ' A' ' 12' ' ' CYS . 1.2 m -127.19 124.18 38.39 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 119.886 3.291 . . . . 1.0 119.886 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.888 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.4 ttm180 -139.33 -87.41 0.22 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -29.52 -69.81 0.06 Allowed 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 119.386 3.106 . . . . 1.0 119.386 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.772 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 25.3 m -86.65 0.54 54.34 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 125.175 2.417 . . . . 1.0 109.867 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.888 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -101.39 -16.26 16.94 Favored 'General case' 0 C--N 1.282 -2.351 0 CA-C-N 109.567 -3.47 . . . . 1.0 113.249 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 38.38 24.83 0.03 OUTLIER Glycine 0 N--CA 1.494 2.535 0 O-C-N 125.15 1.531 . . . . 1.0 112.613 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.405 ' CG2' ' H ' ' A' ' 35' ' ' ABA . 0.0 OUTLIER -113.74 -83.45 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.168 2.284 . . . . 1.0 117.168 -179.706 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.405 ' H ' ' CG2' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.569 ' N ' ' O ' ' A' ' 10' ' ' SER . 3.1 tpp180 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 117.401 -1.285 . . . . 1.0 113.053 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 p -121.84 26.22 8.77 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 120.022 1.283 . . . . 1.0 109.836 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.477 HG22 ' SG ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -101.43 -66.98 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 N-CA-C 106.299 -1.741 . . . . 1.0 106.299 179.856 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.427 ' CG ' ' N ' ' A' ' 6' ' ' THR . 3.2 t70 -162.8 -94.88 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.014 0.821 . . . . 1.0 110.01 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.427 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 60.1 p -19.17 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 119.224 3.046 . . . . 1.0 119.224 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.572 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 5.2 pt -128.07 32.68 0.23 Allowed Pre-proline 0 N--CA 1.506 2.357 0 N-CA-C 114.832 1.419 . . . . 1.0 114.832 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 7' ' ' ILE . 72.1 Cg_endo -73.33 72.78 3.44 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 124.821 3.681 . . . . 1.0 109.264 -174.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -62.25 35.85 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 117.905 2.557 . . . . 1.0 117.905 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.569 ' O ' ' N ' ' A' ' 1' ' ' ARG . 32.5 p -173.26 -93.26 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 113.846 1.054 . . . . 1.0 113.846 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -145.11 36.83 1.13 Allowed 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 125.638 1.575 . . . . 1.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.753 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -97.67 136.54 37.89 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 118.458 -1.297 . . . . 1.0 108.454 -179.464 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.437 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -153.49 156.62 38.46 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.506 0.504 . . . . 1.0 110.168 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.56 -4.54 34.67 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.512 -1.292 . . . . 1.0 107.512 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -93.08 0.38 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.29 -1.374 . . . . 1.0 107.29 179.84 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.445 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -151.67 -60.32 0.17 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.172 0.92 . . . . 1.0 112.844 178.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.562 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.1 t -29.77 -50.67 0.11 Allowed 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 122.85 1.31 . . . . 1.0 110.509 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 tppp? -172.55 76.73 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 111.062 -2.79 . . . . 1.0 112.506 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.551 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.8 m-70 -29.73 -81.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 116.09 1.885 . . . . 1.0 116.09 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.66 61.27 1.8 Allowed 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 116.965 2.209 . . . . 1.0 116.965 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' O ' ' C ' ' A' ' 22' ' ' LYS . . . -169.31 -7.03 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 112.107 -2.315 . . . . 1.0 109.599 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.429 ' C ' ' O ' ' A' ' 21' ' ' ALA . 14.3 pttt -48.49 -54.29 14.8 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 116.497 -2.081 . . . . 1.0 108.906 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -59.85 -4.16 0.66 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 124.723 1.265 . . . . 1.0 113.301 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 -105.18 -41.81 5.46 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.965 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.496 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.06 -65.18 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 1 N-CA-C 99.802 -4.147 . . . . 1.0 99.802 179.192 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 177.66 -59.13 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.532 0 O-C-N 125.968 2.043 . . . . 1.0 106.756 179.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -157.15 -64.37 0.1 Allowed 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.484 -2.144 . . . . 1.0 111.738 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -103.93 153.93 20.23 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 112.766 -2.015 . . . . 1.0 107.259 -179.618 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.547 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -178.17 -89.35 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.957 1.303 . . . . 1.0 113.135 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -30.66 -49.67 0.12 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.991 2.589 . . . . 1.0 117.991 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.562 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 44.2 m -104.4 -4.62 22.58 Favored 'General case' 0 N--CA 1.51 2.531 0 CA-C-N 112.786 -2.006 . . . . 1.0 111.303 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 7.0 m -99.97 169.11 9.42 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 111.113 -2.767 . . . . 1.0 114.725 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.11 36.45 3.63 Favored Glycine 0 N--CA 1.501 3.032 0 N-CA-C 109.082 -1.607 . . . . 1.0 109.082 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.9 t -109.64 -53.04 2.71 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 115.908 1.818 . . . . 1.0 115.908 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.453 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 . . . . . 0 N--CA 1.507 2.386 0 N-CA-C 101.353 -3.573 . . . . 1.0 101.353 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.52 -163.01 1.41 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 110.157 -3.202 . . . . 1.0 106.771 -178.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.454 ' N ' ' O ' ' A' ' 10' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.575 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -100.49 -117.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 102.545 -3.132 . . . . 1.0 102.545 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.447 ' H ' ' CG1' ' A' ' 4' ' ' ILE . 2.1 t70 -81.55 20.87 0.85 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 124.264 0.977 . . . . 1.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.555 HG22 ' SG ' ' A' ' 12' ' ' CYS . 0.2 OUTLIER -85.3 158.39 20.31 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 117.449 -1.7 . . . . 1.0 110.454 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -52.12 75.81 Favored Pre-proline 0 N--CA 1.51 2.556 0 N-CA-C 113.686 0.995 . . . . 1.0 113.686 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.544 ' CG ' ' H ' ' A' ' 33' ' ' GLY . 1.0 OUTLIER -78.26 91.91 1.17 Allowed 'Trans proline' 0 C--N 1.311 -1.421 0 N-CA-C 102.756 -3.594 . . . . 1.0 102.756 -172.239 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -68.13 55.42 0.07 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 125.343 1.652 . . . . 1.0 113.512 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.454 ' O ' ' N ' ' A' ' 3' ' ' ABA . 25.5 m -127.3 -118.69 0.26 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.798 -2.001 . . . . 1.0 105.825 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.56 72.26 1.38 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 120.015 1.28 . . . . 1.0 111.725 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.73 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -134.17 111.91 10.68 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.736 -1.574 . . . . 1.0 107.534 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.442 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -139.29 151.77 46.71 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.551 -2.018 . . . . 1.0 105.551 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.408 ' O ' ' HA ' ' A' ' 19' ' ' HIS . . . -76.22 6.98 4.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.721 -1.992 . . . . 1.0 105.675 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -95.38 1.4 54.23 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 105.45 -2.056 . . . . 1.0 105.45 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.414 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.28 -62.0 0.1 Allowed 'General case' 0 C--N 1.306 -1.304 0 O-C-N 124.023 0.827 . . . . 1.0 112.08 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.73 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -29.79 -44.44 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 O-C-N 124.668 1.23 . . . . 1.0 113.299 -179.162 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 8.1 tppt? -179.19 72.88 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 112.307 -2.224 . . . . 1.0 110.411 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.506 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 84.9 m-70 -29.13 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 116.825 2.158 . . . . 1.0 116.825 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.6 71.04 4.06 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 123.177 1.465 . . . . 1.0 110.003 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HA ' ' CZ ' ' A' ' 24' ' ' ARG . . . -167.89 -11.38 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 112.861 -1.972 . . . . 1.0 110.697 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.495 ' HA ' ' CD2' ' A' ' 25' ' ' LEU . 25.0 pttm -47.57 -44.49 26.27 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 118.395 -1.322 . . . . 1.0 109.942 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 42.9 p90 -70.57 1.54 5.07 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.294 -1.321 . . . . 1.0 113.241 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.464 ' NH1' ' CZ ' ' A' ' 23' ' ' TYR . 2.9 ttp180 -107.54 -54.74 2.44 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 114.683 -1.144 . . . . 1.0 109.356 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.578 ' CG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -80.09 -71.25 0.46 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 103.596 -2.742 . . . . 1.0 103.596 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m 177.98 -52.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 103.258 -2.867 . . . . 1.0 103.258 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.404 ' C ' HD21 ' A' ' 25' ' ' LEU . 46.5 m-85 -155.06 -50.89 0.09 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.472 -3.058 . . . . 1.0 109.927 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.514 ' SG ' ' CG2' ' A' ' 6' ' ' THR . 1.6 m -120.69 146.27 46.6 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 115.295 1.591 . . . . 1.0 115.295 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.747 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -162.85 -31.19 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 116.517 2.043 . . . . 1.0 116.517 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 tptm -100.26 -42.0 6.84 Favored 'General case' 0 N--CA 1.525 3.293 0 N-CA-C 119.601 3.186 . . . . 1.0 119.601 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.712 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 73.2 m -103.69 7.78 37.37 Favored 'General case' 0 N--CA 1.525 3.292 0 CA-C-O 125.598 2.618 . . . . 1.0 109.215 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.747 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -98.67 152.92 19.11 Favored 'General case' 0 C--N 1.282 -2.355 1 CA-C-N 108.105 -4.134 . . . . 1.0 112.481 -179.666 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.544 ' H ' ' CG ' ' A' ' 8' ' ' PRO . . . -116.77 41.94 1.99 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 105.715 -2.954 . . . . 1.0 105.715 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.2 t -124.11 -61.51 1.35 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-N 114.846 -0.677 . . . . 1.0 110.612 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.536 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 . . . . . 0 N--CA 1.505 2.317 0 N-CA-C 101.418 -3.549 . . . . 1.0 101.418 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.35 -142.27 0.15 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 111.423 -2.626 . . . . 1.0 105.975 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.408 ' HB2' ' H ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.667 ' CG1' ' H ' ' A' ' 5' ' ' ASP 0.306 0.0 OUTLIER -119.29 -129.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.623 1 N-CA-C 97.287 -5.079 . . . . 1.0 97.287 179.417 . . . . . . . . 5 4 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.667 ' H ' ' CG1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -130.31 67.67 1.47 Allowed 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 107.498 -1.297 . . . . 1.0 107.498 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -101.08 -142.76 0.34 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.423 -1.717 . . . . 1.0 106.59 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -95.61 -57.34 0.2 Allowed Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 105.964 -1.865 . . . . 1.0 105.964 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.489 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 17.9 Cg_endo -68.42 82.62 0.51 Allowed 'Trans proline' 0 N--CA 1.488 1.168 0 C-N-CA 121.227 1.285 . . . . 1.0 109.518 170.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -72.81 69.81 0.95 Allowed 'General case' 0 C--N 1.296 -1.731 0 CA-C-O 122.016 0.912 . . . . 1.0 110.463 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 83.9 p -127.9 -99.67 0.36 Allowed 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 114.607 1.336 . . . . 1.0 114.607 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -135.07 36.71 3.03 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 124.595 1.158 . . . . 1.0 110.472 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -112.66 134.24 54.28 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 106.708 -1.59 . . . . 1.0 106.708 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.93 156.55 42.44 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 114.833 -1.076 . . . . 1.0 108.547 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -79.66 -0.67 34.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 105.762 -1.94 . . . . 1.0 105.762 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -91.59 1.76 56.92 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 105.927 -1.879 . . . . 1.0 105.927 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.416 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.91 -56.63 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 178.439 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.9 t -30.37 -52.87 0.16 Allowed 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 125.699 2.666 . . . . 1.0 111.881 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.432 ' HZ2' ' CB ' ' A' ' 30' ' ' LYS . 1.2 tppm? -168.04 74.26 0.12 Allowed 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 109.92 -3.309 . . . . 1.0 111.601 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.464 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 92.1 m-70 -29.66 -79.01 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 114.803 1.408 . . . . 1.0 114.803 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.86 27.68 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 118.462 2.764 . . . . 1.0 118.462 -179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' O ' ' CD2' ' A' ' 25' ' ' LEU . . . -141.12 2.91 1.75 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.9 pttp -62.88 -21.7 66.17 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 116.879 -1.929 . . . . 1.0 108.78 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -95.79 7.9 45.02 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.472 -1.24 . . . . 1.0 108.681 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.433 ' HB3' HH21 ' A' ' 24' ' ' ARG . 4.5 mtp85 -111.05 -46.95 3.26 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 114.692 -1.14 . . . . 1.0 111.308 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.519 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.22 -88.02 0.25 Allowed 'General case' 0 N--CA 1.485 1.283 1 N-CA-C 96.999 -5.186 . . . . 1.0 96.999 179.177 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.481 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 20.2 m -161.49 -46.42 0.04 OUTLIER 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.941 -1.503 . . . . 1.0 106.941 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -162.78 -58.14 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 123.55 1.643 . . . . 1.0 111.736 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.791 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -116.25 131.44 56.94 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 111.078 -2.783 . . . . 1.0 112.745 -179.229 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.539 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 11.9 ttp85 -161.13 -49.63 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 N-CA-C 115.869 1.803 . . . . 1.0 115.869 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.498 ' C ' ' H ' ' A' ' 32' ' ' CYS . 3.8 tmtt? -70.17 -79.07 0.07 Allowed 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 117.708 -1.597 . . . . 1.0 107.487 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.595 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -59.49 -9.86 2.85 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 123.491 1.615 . . . . 1.0 109.672 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.791 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 2.5 m -98.73 -16.96 18.77 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 111.925 -2.398 . . . . 1.0 116.8 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 34.4 27.11 0.01 OUTLIER Glycine 0 N--CA 1.502 3.066 0 N-CA-C 115.362 0.905 . . . . 1.0 115.362 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.56 ' CG2' ' H ' ' A' ' 35' ' ' ABA . 1.8 t -102.09 -88.34 0.39 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 117.265 0.532 . . . . 1.0 110.765 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.56 ' H ' ' CG2' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 . . . . . 0 N--CA 1.496 1.857 0 N-CA-C 106.016 -1.846 . . . . 1.0 106.016 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 t 179.95 -168.32 0.11 Allowed 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 105.913 -1.884 . . . . 1.0 105.913 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.596 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 0.1 OUTLIER -107.63 -124.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 106.565 -1.643 . . . . 1.0 106.565 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.415 ' H ' HG12 ' A' ' 4' ' ' ILE . 2.9 m-20 -85.57 35.02 0.59 Allowed 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 113.777 1.029 . . . . 1.0 113.777 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.461 HG21 ' SG ' ' A' ' 28' ' ' CYS . 3.3 m -90.02 -170.15 2.68 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.408 ' CD1' ' N ' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -91.81 -58.25 0.23 Allowed Pre-proline 0 N--CA 1.502 2.139 0 C-N-CA 119.304 -0.958 . . . . 1.0 111.615 -179.457 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -60.05 88.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.229 0 C-N-CA 122.198 1.932 . . . . 1.0 107.665 172.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 71.04 0.15 Allowed 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 121.855 0.836 . . . . 1.0 109.281 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.6 m -140.21 -113.91 0.14 Allowed 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.499 HH21 ' CG2' ' A' ' 31' ' ' THR . 0.0 OUTLIER -127.67 75.05 1.57 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 124.107 0.88 . . . . 1.0 108.687 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.78 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -142.24 123.12 14.4 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 103.748 -2.686 . . . . 1.0 103.748 179.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.473 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -152.38 143.3 23.0 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 116.881 -1.533 . . . . 1.0 107.924 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.07 -13.24 6.29 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 117.67 -1.612 . . . . 1.0 107.022 179.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.508 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -80.98 7.92 9.62 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.538 0.685 . . . . 1.0 110.836 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.535 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -164.8 -62.03 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.05 -1.432 . . . . 1.0 111.614 178.352 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.78 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -33.02 -50.02 0.26 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.874 1.321 . . . . 1.0 110.451 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.499 ' HA ' ' NZ ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -161.57 62.29 0.26 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.428 -2.169 . . . . 1.0 115.342 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.535 ' NE2' ' HA ' ' A' ' 16' ' ' GLN . 91.7 m-70 -29.56 -84.02 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 113.836 1.05 . . . . 1.0 113.836 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.13 71.73 4.62 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 124.51 2.1 . . . . 1.0 108.576 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.548 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . 179.43 -10.0 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 111.81 -2.45 . . . . 1.0 109.43 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.424 ' C ' ' O ' ' A' ' 21' ' ' ALA . 4.9 pttp -50.12 -45.64 53.12 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 115.617 -2.433 . . . . 1.0 107.621 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -70.57 7.01 1.19 Allowed 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.174 1.176 . . . . 1.0 114.174 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.548 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 3.3 mtp85 -108.73 -45.92 3.74 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.121 -1.066 . . . . 1.0 108.121 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.457 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.75 -62.58 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 105.937 -1.875 . . . . 1.0 105.937 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.421 ' H ' HD21 ' A' ' 25' ' ' LEU . 1.1 m 178.55 -55.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 103.29 -2.856 . . . . 1.0 103.29 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -152.56 -60.19 0.15 Allowed 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 111.159 -2.746 . . . . 1.0 108.493 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.486 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.1 m -119.14 148.08 43.47 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 111.655 -2.52 . . . . 1.0 116.537 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.898 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 7.5 tmm_? -176.93 -22.53 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 117.327 2.343 . . . . 1.0 117.327 178.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.405 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -84.58 -37.98 20.5 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 121.55 1.977 . . . . 1.0 114.405 -179.807 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.652 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 0.8 OUTLIER -103.9 -18.39 14.64 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 123.727 1.727 . . . . 1.0 108.611 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.898 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.98 -40.33 12.41 Favored 'General case' 0 C--N 1.283 -2.316 0 CA-C-N 109.549 -3.478 . . . . 1.0 115.615 -179.507 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 42.86 33.54 1.68 Allowed Glycine 0 N--CA 1.51 3.576 0 N-CA-C 109.487 -1.445 . . . . 1.0 109.487 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.4 t -110.85 -35.27 6.01 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 112.428 -1.886 . . . . 1.0 114.917 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.513 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 103.719 -2.697 . . . . 1.0 103.719 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.57 -157.86 0.84 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 111.409 -2.632 . . . . 1.0 105.754 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.546 ' CD1' ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -107.0 -91.06 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 N-CA-C 106.034 -1.839 . . . . 1.0 106.034 179.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.546 ' H ' ' CD1' ' A' ' 4' ' ' ILE . 1.1 t70 -142.77 -92.2 0.12 Allowed 'General case' 0 N--CA 1.487 1.39 0 O-C-N 123.973 0.796 . . . . 1.0 110.435 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.431 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 39.7 p -19.41 -93.8 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.053 2.983 . . . . 1.0 119.053 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.408 ' CD1' ' N ' ' A' ' 7' ' ' ILE . 0.1 OUTLIER -132.73 47.5 2.78 Favored Pre-proline 0 N--CA 1.507 2.392 0 N-CA-C 116.632 2.086 . . . . 1.0 116.632 -179.767 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' C ' ' H ' ' A' ' 10' ' ' SER . 88.3 Cg_endo -78.42 98.02 1.17 Allowed 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.714 2.942 . . . . 1.0 107.688 178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.62 24.38 0.29 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.025 0.917 . . . . 1.0 112.042 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER 179.21 -111.03 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 114.741 -1.118 . . . . 1.0 110.369 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -127.52 57.82 1.5 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.893 0.854 . . . . 1.0 110.954 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -111.88 137.64 49.57 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 102.782 -3.044 . . . . 1.0 102.782 179.465 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.42 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -147.47 166.96 25.68 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 104.932 -2.247 . . . . 1.0 104.932 179.752 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -82.09 3.95 24.95 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 106.158 -1.793 . . . . 1.0 106.158 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.582 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -102.0 4.38 39.82 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 113.133 -1.849 . . . . 1.0 106.841 179.616 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.42 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.96 -58.02 0.15 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.107 178.153 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.63 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 3.1 t -36.38 -50.14 0.75 Allowed 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.132 1.444 . . . . 1.0 110.637 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -169.74 69.45 0.06 Allowed 'General case' 0 C--N 1.302 -1.478 0 CA-C-N 112.183 -2.281 . . . . 1.0 114.858 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.582 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.5 m-70 -29.73 -67.75 0.08 Allowed 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 123.241 1.496 . . . . 1.0 112.095 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -78.88 55.46 1.74 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 116.693 2.108 . . . . 1.0 116.693 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.28 -4.39 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 111.445 -2.616 . . . . 1.0 108.965 179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 pttp -48.91 -53.58 19.03 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 115.784 -2.366 . . . . 1.0 108.122 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -61.67 0.83 0.29 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 113.304 -1.771 . . . . 1.0 113.349 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -109.45 -48.37 3.25 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 114.01 1.115 . . . . 1.0 114.01 -179.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -80.3 -63.01 1.51 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 102.147 -3.279 . . . . 1.0 102.147 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.406 ' H ' HD22 ' A' ' 25' ' ' LEU . 0.8 OUTLIER 177.6 -58.92 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 102.349 -3.204 . . . . 1.0 102.349 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -157.64 -64.13 0.09 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 111.736 -2.484 . . . . 1.0 114.171 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.737 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.15 122.35 47.51 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.279 1.585 . . . . 1.0 115.279 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.63 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 tmm_? -149.46 -73.33 0.18 Allowed 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 117.946 2.572 . . . . 1.0 117.946 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.75 -31.68 0.86 Allowed 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 117.677 2.473 . . . . 1.0 117.677 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.581 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -112.92 -2.29 14.34 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 125.523 1.764 . . . . 1.0 110.333 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 12.2 m -107.23 158.32 17.21 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 112.158 -2.292 . . . . 1.0 115.559 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.32 36.49 3.96 Favored Glycine 0 N--CA 1.493 2.447 0 CA-C-N 113.574 -1.648 . . . . 1.0 110.56 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.428 ' OG1' ' N ' ' A' ' 35' ' ' ABA . 0.1 OUTLIER -118.42 -98.21 0.45 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 107.53 -1.285 . . . . 1.0 107.53 179.552 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.428 ' N ' ' OG1' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.075 0 N-CA-C 101.457 -3.535 . . . . 1.0 101.457 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -170.6 -169.08 0.76 Allowed 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 103.52 -2.77 . . . . 1.0 103.52 -178.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.444 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -121.05 -82.75 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 N-CA-C 105.224 -2.139 . . . . 1.0 105.224 179.759 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.507 ' CG ' ' N ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -139.54 -86.14 0.23 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 124.254 0.971 . . . . 1.0 111.194 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.507 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 0.1 OUTLIER -18.52 -113.1 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 119.628 3.196 . . . . 1.0 119.628 -179.643 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.517 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 pt -129.39 44.68 1.45 Allowed Pre-proline 0 N--CA 1.504 2.234 0 O-C-N 120.914 -1.116 . . . . 1.0 112.532 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.579 ' HB3' ' SG ' ' A' ' 12' ' ' CYS . 83.4 Cg_endo -77.62 90.04 1.28 Allowed 'Trans proline' 0 C--N 1.31 -1.452 0 C-N-CA 123.815 3.01 . . . . 1.0 107.181 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -69.3 32.0 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 114.779 1.4 . . . . 1.0 114.779 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.436 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER 179.69 -109.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.697 0.799 . . . . 1.0 109.744 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -130.88 51.76 2.11 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 121.347 0.594 . . . . 1.0 112.042 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.787 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -99.87 128.1 45.98 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 106.122 -1.807 . . . . 1.0 106.122 179.793 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.458 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -144.85 158.77 43.68 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.014 -1.476 . . . . 1.0 107.014 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.04 6.35 11.71 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.251 -1.759 . . . . 1.0 106.251 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.557 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -99.85 1.84 43.33 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 104.472 -2.418 . . . . 1.0 104.472 179.255 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.458 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -62.26 0.16 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.674 0.99 . . . . 1.0 113.674 178.34 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.5 t -29.67 -48.89 0.09 Allowed 'General case' 0 N--CA 1.507 2.39 0 CA-C-O 123.493 1.616 . . . . 1.0 114.294 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -174.07 72.0 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 109.997 -3.274 . . . . 1.0 109.15 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.557 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 80.0 m-70 -28.99 -77.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 117.394 2.368 . . . . 1.0 117.394 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.98 49.5 0.55 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 116.079 1.881 . . . . 1.0 116.079 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.29 -3.36 0.42 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.443 -0.903 . . . . 1.0 109.208 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -57.38 -29.44 64.05 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 116.836 -1.946 . . . . 1.0 110.248 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -84.09 0.72 47.28 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 115.123 -0.944 . . . . 1.0 110.058 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.3 mtp85 -107.25 -49.48 3.26 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 114.444 -1.253 . . . . 1.0 112.357 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.569 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -96.1 -62.05 1.34 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 105.231 -2.137 . . . . 1.0 105.231 179.833 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.408 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 1.2 m 178.77 -54.31 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.218 -1.401 . . . . 1.0 107.218 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.408 ' CG ' ' O ' ' A' ' 26' ' ' SER . 63.7 m-85 -163.24 -61.77 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.67 -1.604 . . . . 1.0 109.37 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.829 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -104.07 153.18 21.19 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 109.278 -3.601 . . . . 1.0 108.664 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.569 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -178.14 -60.09 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 115.2 1.556 . . . . 1.0 115.2 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 32' ' ' CYS . 25.7 tptt -70.56 -74.76 0.13 Allowed 'General case' 0 N--CA 1.519 2.983 0 C-N-CA 118.139 -1.425 . . . . 1.0 108.336 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.479 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 23.9 m -59.95 -10.77 4.45 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.201 1.477 . . . . 1.0 110.355 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.829 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m -96.71 -16.41 20.92 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 111.86 -2.427 . . . . 1.0 115.682 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 29.61 33.94 0.01 OUTLIER Glycine 0 N--CA 1.504 3.182 0 O-C-N 125.355 1.659 . . . . 1.0 112.77 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.481 ' N ' ' O ' ' A' ' 32' ' ' CYS . 4.8 t -99.38 -45.67 5.77 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 . . . . . 0 N--CA 1.494 1.74 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.1 t 178.98 -151.94 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 101.918 -3.364 . . . . 1.0 101.918 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.503 ' HA ' ' O ' ' A' ' 8' ' ' PRO . 0.7 OUTLIER -84.75 -27.24 6.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 CA-C-N 112.36 -2.2 . . . . 1.0 109.293 179.777 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.557 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 8.8 t70 46.82 -76.23 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 CA-C-N 111.058 -2.792 . . . . 1.0 114.145 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.403 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -101.37 -80.04 0.5 Allowed 'General case' 0 C--N 1.295 -1.789 0 O-C-N 125.327 1.642 . . . . 1.0 109.257 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.71 -63.23 0.03 OUTLIER Pre-proline 0 C--N 1.303 -1.444 0 CA-C-N 113.49 -1.686 . . . . 1.0 111.777 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 2.9 Cg_exo -62.77 124.65 14.47 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 C-N-CA 123.462 2.775 . . . . 1.0 108.071 -157.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 66.64 8.08 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 103.804 -2.665 . . . . 1.0 103.804 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -125.6 -136.84 0.27 Allowed 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 106.227 -1.768 . . . . 1.0 106.227 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.88 71.62 1.4 Allowed 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.065 -1.828 . . . . 1.0 106.065 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.766 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER -136.79 136.22 38.67 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 104.913 -2.255 . . . . 1.0 104.913 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.466 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -158.4 160.03 36.42 Favored 'General case' 0 C--N 1.296 -1.755 0 C-N-CA 119.363 -0.935 . . . . 1.0 110.082 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB3' ' HB3' ' A' ' 22' ' ' LYS . . . -78.23 9.5 3.75 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 106.831 -1.544 . . . . 1.0 106.831 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.562 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -108.03 1.99 22.83 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 104.305 -2.48 . . . . 1.0 104.305 179.468 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.466 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -153.01 -62.9 0.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 115.926 -0.579 . . . . 1.0 112.539 178.437 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 31' ' ' THR . 1.6 t -29.09 -57.99 0.14 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 123.827 1.775 . . . . 1.0 111.806 -179.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -165.93 73.53 0.18 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 109.799 -3.364 . . . . 1.0 109.527 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.562 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.9 m-70 -28.75 -79.03 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 119.685 3.217 . . . . 1.0 119.685 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.97 49.91 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.798 1.777 . . . . 1.0 115.798 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -149.94 -1.51 0.42 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.189 -0.945 . . . . 1.0 108.56 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.401 ' HB3' ' HB3' ' A' ' 14' ' ' ALA . 19.7 pttt -58.98 -25.41 63.56 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 117.626 -1.63 . . . . 1.0 111.616 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -86.48 0.51 54.07 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.63 -1.168 . . . . 1.0 108.793 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.6 mtp85 -109.93 -48.62 3.18 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.109 -1.405 . . . . 1.0 110.791 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.527 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -91.92 -69.21 0.75 Allowed 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 103.069 -2.938 . . . . 1.0 103.069 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.416 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 4.0 m 178.92 -49.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 107.039 -1.467 . . . . 1.0 107.039 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.416 ' CG ' ' O ' ' A' ' 26' ' ' SER . 24.6 m-85 -167.03 -84.17 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 105.696 -1.964 . . . . 1.0 105.696 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -81.48 153.16 27.0 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 115.592 -0.731 . . . . 1.0 111.008 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.531 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 tmm_? -171.52 -90.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.551 1.685 . . . . 1.0 115.551 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.403 ' H ' ' HB3' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -33.07 -54.08 0.38 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 117.766 2.506 . . . . 1.0 117.766 -179.78 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.59 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 8.6 m -88.48 -6.21 57.76 Favored 'General case' 0 N--CA 1.514 2.749 0 C-N-CA 125.785 1.634 . . . . 1.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 4.1 m -102.33 -84.77 0.45 Allowed 'General case' 0 C--N 1.287 -2.149 0 CA-C-N 110.817 -2.902 . . . . 1.0 112.182 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 109.62 -0.52 30.66 Favored Glycine 0 N--CA 1.504 3.173 0 N-CA-C 109.272 -1.531 . . . . 1.0 109.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.3 t -72.27 -25.42 61.59 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.899 0.857 . . . . 1.0 108.843 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.462 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 103.48 -2.785 . . . . 1.0 103.48 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -132.34 96.07 3.78 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.005 -1.078 . . . . 1.0 109.08 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.484 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -107.25 -35.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 125.803 1.94 . . . . 1.0 112.341 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.443 ' N ' HD11 ' A' ' 4' ' ' ILE . 1.2 t0 56.81 -82.72 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 105.535 -2.024 . . . . 1.0 105.535 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -103.01 -58.95 1.78 Allowed 'General case' 0 C--N 1.299 -1.622 0 O-C-N 123.982 0.801 . . . . 1.0 110.011 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -131.74 -54.32 0.03 OUTLIER Pre-proline 0 N--CA 1.498 1.943 0 N-CA-C 119.045 2.98 . . . . 1.0 119.045 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.538 ' O ' ' N ' ' A' ' 10' ' ' SER . 5.5 Cg_endo -76.13 55.19 4.45 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 123.509 2.806 . . . . 1.0 116.398 -161.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -30.56 65.92 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 118.582 2.808 . . . . 1.0 118.582 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 8' ' ' PRO . 40.6 m -143.52 -97.09 0.11 Allowed 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.347 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -129.77 39.78 3.66 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.343 0.498 . . . . 1.0 112.343 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -122.45 129.33 51.92 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.823 -1.177 . . . . 1.0 107.823 -179.816 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.505 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -156.06 145.89 21.2 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 116.296 -1.811 . . . . 1.0 108.218 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.429 ' O ' ' HA ' ' A' ' 19' ' ' HIS . . . -62.88 -7.04 4.36 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 117.753 -1.579 . . . . 1.0 107.565 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.528 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 1.0 OUTLIER -87.88 1.7 53.36 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.372 -0.83 . . . . 1.0 109.362 179.652 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.488 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -153.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.191 0.932 . . . . 1.0 110.531 179.343 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -32.79 -42.06 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 114.506 1.299 . . . . 1.0 114.506 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? 179.9 72.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 126.623 2.452 . . . . 1.0 112.141 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.03 -91.67 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.348 2.722 . . . . 1.0 118.348 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 41.19 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.018 1.859 . . . . 1.0 116.018 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -142.42 -1.52 1.16 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.921 -1.14 . . . . 1.0 107.921 179.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -54.79 -36.82 65.31 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 117.35 -1.74 . . . . 1.0 109.263 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -79.02 2.11 21.62 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.232 -1.349 . . . . 1.0 111.517 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.7 mtp85 -108.5 -40.16 5.2 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.019 -0.991 . . . . 1.0 111.914 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.54 ' HG ' ' CB ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.05 -79.21 0.42 Allowed 'General case' 0 N--CA 1.483 1.214 1 N-CA-C 96.77 -5.27 . . . . 1.0 96.77 179.078 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -170.02 -51.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.513 1.133 . . . . 1.0 108.006 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -155.43 -71.37 0.12 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.591 -2.095 . . . . 1.0 107.437 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.497 ' SG ' ' C ' ' A' ' 12' ' ' CYS . 0.5 OUTLIER -115.07 139.93 49.47 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 111.482 -2.599 . . . . 1.0 108.468 -179.745 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.87 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -151.84 -55.47 0.14 Allowed 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 118.426 2.75 . . . . 1.0 118.426 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.555 ' C ' ' H ' ' A' ' 32' ' ' CYS . 21.7 tptp -66.09 -81.95 0.03 OUTLIER 'General case' 0 N--CA 1.527 3.413 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.609 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.672 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.7 m -62.55 -5.11 2.32 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 124.53 2.11 . . . . 1.0 111.517 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.87 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.93 -31.55 13.61 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-N 109.444 -3.525 . . . . 1.0 112.04 -179.895 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 38.34 31.6 0.12 Allowed Glycine 0 N--CA 1.507 3.41 0 O-C-N 124.32 1.013 . . . . 1.0 111.247 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.79 -38.62 5.57 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 113.752 -1.224 . . . . 1.0 112.924 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.524 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.6 ttm180 . . . . . 0 N--CA 1.496 1.851 0 N-CA-C 102.734 -3.061 . . . . 1.0 102.734 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 3' ' ' ABA . 5.6 m -118.66 58.16 0.84 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 125.071 1.482 . . . . 1.0 111.648 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ABA . . . . . 0.423 ' C ' ' O ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.5 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -101.55 -46.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 CA-C-N 112.311 -2.222 . . . . 1.0 110.488 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.405 ' C ' HD11 ' A' ' 4' ' ' ILE . 0.8 OUTLIER 55.44 -76.84 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.189 0 CA-C-N 120.259 1.39 . . . . 1.0 110.432 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -101.55 -106.47 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.082 -1.451 . . . . 1.0 107.082 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.492 ' N ' ' OG1' ' A' ' 6' ' ' THR . 1.1 pp -140.49 47.16 1.08 Allowed Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.693 ' HG3' ' SG ' ' A' ' 12' ' ' CYS . 29.4 Cg_endo -92.57 154.89 2.94 Favored 'Trans proline' 0 C--N 1.315 -1.225 1 C-N-CA 125.86 4.374 . . . . 1.0 107.416 175.925 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 35.16 2.32 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 113.021 0.748 . . . . 1.0 113.021 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.2 m -141.51 -106.42 0.14 Allowed 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 119.007 2.965 . . . . 1.0 119.007 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 75.24 0.99 Allowed 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 105.855 -1.906 . . . . 1.0 105.855 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 14.5 p -124.14 42.11 3.33 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 123.258 1.504 . . . . 1.0 110.992 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.416 ' OG1' ' CD2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -57.27 140.61 49.4 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 117.434 -1.706 . . . . 1.0 108.397 -179.504 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -49.27 -24.19 1.71 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 124.794 1.309 . . . . 1.0 107.95 178.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.642 ' CD1' ' N ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -73.68 9.32 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 120.949 0.404 . . . . 1.0 111.791 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.459 ' HG2' ' C ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -152.31 -59.33 0.15 Allowed 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 108.648 -0.871 . . . . 1.0 108.648 178.615 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.605 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.9 t -40.98 -48.52 3.2 Favored 'General case' 0 N--CA 1.517 2.908 0 CA-C-O 122.818 1.294 . . . . 1.0 111.972 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.32 71.63 0.08 Allowed 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 112.407 -2.179 . . . . 1.0 114.776 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.6 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -28.76 -60.59 0.13 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.515 -1.22 . . . . 1.0 113.862 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.0 p -88.98 22.56 2.68 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 121.259 3.8 . . . . 1.0 121.259 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -140.88 3.77 1.85 Allowed 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 117.245 -1.782 . . . . 1.0 106.901 178.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.411 ' CG ' ' H ' ' A' ' 23' ' ' TYR . 0.0 OUTLIER -49.98 -55.74 13.44 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 116.169 -2.213 . . . . 1.0 108.423 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.411 ' H ' ' CG ' ' A' ' 22' ' ' LYS . 10.8 p90 -60.78 -13.78 17.34 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 114.284 -1.325 . . . . 1.0 112.694 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -86.71 -42.41 13.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 120.459 -0.496 . . . . 1.0 110.467 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.511 ' HG ' ' CG ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.54 -58.33 2.56 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 103.97 -2.604 . . . . 1.0 103.97 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 178.57 -62.35 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.524 -1.658 . . . . 1.0 106.524 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -150.95 -65.01 0.19 Allowed 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 110.493 -3.048 . . . . 1.0 114.671 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.793 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -101.22 143.52 31.19 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 113.233 -1.803 . . . . 1.0 114.224 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.749 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -167.76 -86.89 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 119.527 3.158 . . . . 1.0 119.527 179.593 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -30.43 0.11 Allowed 'General case' 0 N--CA 1.525 3.32 0 N-CA-C 119.343 3.09 . . . . 1.0 119.343 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.605 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 88.4 m -112.59 -7.74 13.86 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.628 1.571 . . . . 1.0 109.758 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 4.3 m -97.6 124.76 42.0 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 111.858 -2.428 . . . . 1.0 113.641 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.43 47.7 3.67 Favored Glycine 0 N--CA 1.5 2.93 0 C-N-CA 120.157 -1.021 . . . . 1.0 111.944 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.17 -85.41 0.6 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 118.445 -0.788 . . . . 1.0 110.303 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ABA . . . . . 0.574 ' C ' HH11 ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.828 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 106.951 -1.5 . . . . 1.0 106.951 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.631 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -153.61 151.31 29.58 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 117.992 -1.004 . . . . 1.0 110.377 -179.899 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -66.46 -11.05 50.13 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.503 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -81.92 2.01 32.58 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.733 -1.21 . . . . 1.0 107.733 179.487 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.631 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.4 OUTLIER -151.5 -66.97 0.18 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.227 0.955 . . . . 1.0 111.986 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.575 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.8 t -29.57 -44.56 0.04 OUTLIER 'General case' 0 N--CA 1.52 3.032 0 CA-C-O 123.229 1.49 . . . . 1.0 112.951 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -172.21 71.22 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 110.709 -2.951 . . . . 1.0 113.437 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.448 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 60.8 m80 -29.56 -84.44 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 114.841 1.423 . . . . 1.0 114.841 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.83 78.26 2.75 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.727 1.727 . . . . 1.0 110.778 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.658 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.72 -12.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 112.367 -2.197 . . . . 1.0 110.035 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.808 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -54.34 -20.15 6.75 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 118.066 -1.454 . . . . 1.0 113.512 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.532 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 29.6 p90 -96.97 5.06 51.16 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 122.105 0.955 . . . . 1.0 109.659 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.532 ' HD3' ' CE1' ' A' ' 23' ' ' TYR . 11.6 mtp85 -109.49 -48.02 3.3 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.946 -1.479 . . . . 1.0 108.14 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.668 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.78 -79.06 0.37 Allowed 'General case' 0 N--CA 1.481 1.123 1 N-CA-C 98.769 -4.53 . . . . 1.0 98.769 178.989 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.7 m 178.71 -43.81 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.824 -1.547 . . . . 1.0 106.824 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 46.7 m-85 -159.77 -64.5 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.529 -1.668 . . . . 1.0 113.959 -179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -111.53 155.84 22.65 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 112.433 -2.167 . . . . 1.0 111.408 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.7 ttp180 -176.55 -89.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 116.874 2.176 . . . . 1.0 116.874 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -39.9 -42.53 1.35 Allowed 'General case' 0 N--CA 1.521 3.107 0 N-CA-C 116.622 2.082 . . . . 1.0 116.622 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 6.9 m -105.21 1.33 28.1 Favored 'General case' 0 N--CA 1.513 2.689 0 CA-C-O 124.449 2.071 . . . . 1.0 111.843 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 5.0 m . . . . . 0 C--N 1.282 -2.363 0 CA-C-N 109.704 -3.407 . . . . 1.0 115.238 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.833 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 102.41 -3.181 . . . . 1.0 102.41 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.546 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -148.92 153.27 37.76 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 113.394 -1.73 . . . . 1.0 109.252 -179.82 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.827 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.72 10.22 4.29 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 105.414 -2.069 . . . . 1.0 105.414 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.558 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -101.95 -0.54 33.66 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 105.233 -2.136 . . . . 1.0 105.233 179.559 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.554 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -158.3 -52.03 0.07 Allowed 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.652 0.612 . . . . 1.0 112.652 178.674 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.0 t -29.86 -55.74 0.17 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 124.952 1.407 . . . . 1.0 110.687 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -168.61 77.87 0.13 Allowed 'General case' 0 N--CA 1.488 1.454 1 O-C-N 129.389 4.18 . . . . 1.0 109.892 -179.607 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.554 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.3 m80 -29.92 -87.84 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.971 2.212 . . . . 1.0 116.971 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.24 77.0 0.25 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 123.245 1.498 . . . . 1.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.696 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.8 -12.8 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.274 -1.785 . . . . 1.0 109.066 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.827 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.9 pttt -55.51 -19.69 10.54 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.163 -1.415 . . . . 1.0 111.725 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -95.97 11.47 33.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.415 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -120.4 -47.32 2.35 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 113.78 -1.555 . . . . 1.0 109.054 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.696 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -91.5 -74.07 0.52 Allowed 'General case' 0 C--N 1.312 -1.026 1 N-CA-C 99.311 -4.329 . . . . 1.0 99.311 179.09 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.01 -50.85 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 123.702 1.715 . . . . 1.0 107.777 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.535 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 62.2 m-85 -161.08 -63.28 0.06 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.296 -3.138 . . . . 1.0 111.901 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.768 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 m -109.82 137.2 47.95 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 113.578 -1.646 . . . . 1.0 114.0 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.533 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 10.1 ttp180 -166.91 -56.4 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 N-CA-C 116.879 2.177 . . . . 1.0 116.879 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -66.25 -79.22 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.62 0 C-N-CA 117.323 -1.751 . . . . 1.0 108.285 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.597 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 59.5 m -59.21 -12.55 5.5 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-O 122.428 1.109 . . . . 1.0 110.257 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.833 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 1.7 m . . . . . 0 C--N 1.291 -1.971 0 N-CA-C 117.73 2.492 . . . . 1.0 117.73 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 105.13 -2.174 . . . . 1.0 105.13 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.658 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -147.97 150.33 33.82 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 117.495 -1.241 . . . . 1.0 109.997 -179.597 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -65.82 -10.84 41.4 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 105.758 -1.942 . . . . 1.0 105.758 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.572 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -81.9 1.7 33.94 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.433 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.658 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.5 OUTLIER -157.34 -60.28 0.09 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.328 1.018 . . . . 1.0 112.432 179.254 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.634 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.7 t -30.61 -45.21 0.06 Allowed 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -174.05 75.21 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 127.86 3.225 . . . . 1.0 113.772 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.459 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 73.8 m-70 -28.8 -94.21 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 118.601 2.815 . . . . 1.0 118.601 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.17 34.71 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.847 1.425 . . . . 1.0 114.847 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.597 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -139.12 0.93 1.98 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 117.857 -1.068 . . . . 1.0 108.318 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.724 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.6 pttp -50.08 -52.34 35.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 116.511 -2.075 . . . . 1.0 108.074 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.434 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 25.3 p90 -62.83 -8.89 7.77 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 114.338 -1.301 . . . . 1.0 112.305 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 mtp85 -97.39 -36.92 10.21 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 118.163 -0.922 . . . . 1.0 110.752 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.711 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -102.03 -58.1 1.94 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.067 -2.197 . . . . 1.0 105.067 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 177.85 -67.56 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 124.44 2.067 . . . . 1.0 106.115 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -157.09 -52.11 0.07 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 108.47 -3.968 . . . . 1.0 112.866 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.778 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -117.93 151.01 38.27 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.383 -1.281 . . . . 1.0 109.143 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.2 tmm_? -167.75 -88.54 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 117.796 2.517 . . . . 1.0 117.796 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HE3' ' OG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -49.96 -22.85 1.7 Allowed 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 117.631 2.456 . . . . 1.0 117.631 -179.316 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.634 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 5.3 m -114.51 -0.49 13.7 Favored 'General case' 0 N--CA 1.513 2.683 0 CA-C-O 124.574 2.13 . . . . 1.0 110.253 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 12' ' ' CYS 0.267 15.5 m . . . . . 0 C--N 1.285 -2.204 0 CA-C-N 108.87 -3.786 . . . . 1.0 108.956 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.837 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 104.114 -2.55 . . . . 1.0 104.114 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.5 HG23 ' OE1' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -158.82 158.0 32.67 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 105.426 -2.064 . . . . 1.0 105.426 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -75.76 -1.71 26.34 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 105.532 -2.025 . . . . 1.0 105.532 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -90.86 2.42 56.16 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 105.867 -1.901 . . . . 1.0 105.867 179.519 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.657 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -154.92 -60.81 0.12 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 112.313 0.486 . . . . 1.0 112.313 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 31' ' ' THR . 2.7 t -31.1 -53.29 0.2 Allowed 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 123.855 1.788 . . . . 1.0 110.33 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.49 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -165.87 71.06 0.14 Allowed 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 111.347 -2.66 . . . . 1.0 113.547 -179.679 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.657 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 79.6 m80 -29.76 -79.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.983 1.105 . . . . 1.0 113.983 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.46 71.6 1.82 Allowed 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 123.981 1.848 . . . . 1.0 113.226 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.791 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.48 -10.81 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 112.27 -2.241 . . . . 1.0 109.68 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.777 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.3 pttt -55.91 -19.26 11.38 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 116.614 -2.034 . . . . 1.0 113.099 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -94.3 2.58 55.84 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 122.083 0.944 . . . . 1.0 110.245 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.431 HH21 ' HB3' ' A' ' 24' ' ' ARG . 3.4 mtp85 -109.46 -46.59 3.52 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 113.462 -1.699 . . . . 1.0 112.341 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.791 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -90.54 -72.19 0.58 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 101.455 -3.535 . . . . 1.0 101.455 179.625 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.7 m 179.58 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.022 -1.473 . . . . 1.0 107.022 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 30.8 m-85 -162.61 -58.64 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 113.241 -1.8 . . . . 1.0 111.302 -179.07 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.761 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.08 155.41 23.9 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.209 -1.359 . . . . 1.0 109.927 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.566 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 9.5 ttp85 -177.83 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 O-C-N 125.095 1.497 . . . . 1.0 113.539 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -35.65 -44.47 0.32 Allowed 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 119.958 3.318 . . . . 1.0 119.958 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.503 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 24.8 m -101.26 -5.72 25.13 Favored 'General case' 0 N--CA 1.508 2.44 0 CA-C-O 123.454 1.597 . . . . 1.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.837 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 6.7 m . . . . . 0 C--N 1.287 -2.13 0 CA-C-N 110.652 -2.976 . . . . 1.0 115.193 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 105.135 -2.172 . . . . 1.0 105.135 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -147.66 163.37 36.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 179.59 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.92 -1.62 40.14 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 106.111 -1.811 . . . . 1.0 106.111 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.497 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.4 OUTLIER -90.51 1.18 56.95 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 104.609 -2.367 . . . . 1.0 104.609 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.563 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -152.59 -61.34 0.15 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.0 t -29.97 -52.21 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 123.947 1.832 . . . . 1.0 110.303 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.597 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -168.9 79.31 0.13 Allowed 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 110.941 -2.845 . . . . 1.0 112.463 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.563 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 76.2 m80 -29.93 -78.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.782 1.771 . . . . 1.0 115.782 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.17 40.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 118.625 2.824 . . . . 1.0 118.625 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -148.48 2.18 0.63 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.349 -1.47 . . . . 1.0 108.388 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.767 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 22.2 pttm -59.32 -28.96 67.28 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 116.881 -1.928 . . . . 1.0 108.35 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 24' ' ' ARG . 17.5 p90 -87.22 9.01 21.52 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 113.82 -1.536 . . . . 1.0 110.282 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.515 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 4.0 mtp85 -114.62 -49.69 2.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.453 -1.249 . . . . 1.0 110.884 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.733 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.77 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 103.434 -2.802 . . . . 1.0 103.434 179.407 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.455 ' H ' HD22 ' A' ' 25' ' ' LEU . 27.7 m 179.75 -51.91 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 105.431 -2.063 . . . . 1.0 105.431 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.476 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 39.0 m-85 -160.33 -66.12 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.783 -2.008 . . . . 1.0 109.33 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.807 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -103.11 156.96 17.32 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 111.764 -2.471 . . . . 1.0 111.987 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.3 ttm180 179.03 -88.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 115.045 1.498 . . . . 1.0 115.045 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.29 -38.91 1.26 Allowed 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 118.412 2.745 . . . . 1.0 118.412 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 32.1 m -104.41 -5.0 22.1 Favored 'General case' 0 N--CA 1.508 2.425 0 CA-C-O 122.693 1.235 . . . . 1.0 108.025 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 23.7 m . . . . . 0 C--N 1.286 -2.155 0 CA-C-N 112.411 -2.177 . . . . 1.0 116.279 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.811 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.279 0 N-CA-C 105.211 -2.144 . . . . 1.0 105.211 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.55 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -148.3 163.59 36.6 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 105.338 -2.097 . . . . 1.0 105.338 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.24 1.96 19.86 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 116.988 -1.885 . . . . 1.0 106.088 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -98.72 1.94 46.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 105.938 -1.875 . . . . 1.0 105.938 179.528 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.552 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 1.0 OUTLIER -150.74 -62.85 0.19 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 123.516 0.51 . . . . 1.0 109.815 178.12 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.662 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -37.79 -51.3 1.27 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 125.075 1.484 . . . . 1.0 111.301 -179.748 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.44 ' CD ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -163.88 68.57 0.18 Allowed 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 116.012 -2.275 . . . . 1.0 114.122 -179.297 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.552 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 76.3 m80 -28.38 -85.16 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 125.034 1.459 . . . . 1.0 114.797 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.465 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.39 46.65 0.27 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 114.375 1.25 . . . . 1.0 114.375 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.622 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . . . -158.48 -0.32 0.09 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.792 -1.549 . . . . 1.0 107.943 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.902 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -56.0 -21.9 23.88 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 116.7 -2.0 . . . . 1.0 111.628 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.58 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 6.6 p90 -94.68 4.0 54.37 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 124.281 0.988 . . . . 1.0 110.662 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.667 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.5 tpp180 -100.76 -49.81 4.05 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.672 -0.862 . . . . 1.0 108.672 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.772 HD12 ' HE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -86.33 -68.87 0.71 Allowed 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 106.654 -1.61 . . . . 1.0 106.654 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.3 m 178.98 -49.83 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 105.19 -2.152 . . . . 1.0 105.19 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 16.2 m-85 -167.27 -50.47 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 109.513 -3.494 . . . . 1.0 109.989 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -116.95 144.31 44.7 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 117.212 2.301 . . . . 1.0 117.212 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.772 ' HE ' HD12 ' A' ' 25' ' ' LEU . 2.3 ttm180 -170.11 -84.99 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 118.271 2.693 . . . . 1.0 118.271 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.3 mmtm -43.94 -23.83 0.11 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 119.425 3.12 . . . . 1.0 119.425 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.662 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 97.0 m -116.91 -8.66 11.27 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 123.795 1.759 . . . . 1.0 108.382 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.811 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.4 m . . . . . 0 C--N 1.288 -2.066 0 CA-C-N 112.104 -2.316 . . . . 1.0 114.621 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.777 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 107.662 -1.236 . . . . 1.0 107.662 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -146.93 155.34 42.21 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 103.12 -2.918 . . . . 1.0 103.12 179.56 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.665 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.7 11.11 3.37 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 116.518 -2.073 . . . . 1.0 105.506 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.525 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -100.76 1.78 40.65 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.786 -1.931 . . . . 1.0 105.786 179.572 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.618 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -155.28 -59.85 0.11 Allowed 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.938 -0.705 . . . . 1.0 110.714 178.568 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.777 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -34.86 -57.82 0.53 Allowed 'General case' 0 N--CA 1.485 1.282 0 O-C-N 125.21 1.569 . . . . 1.0 110.453 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.545 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -162.5 72.06 0.33 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 112.396 -2.184 . . . . 1.0 113.022 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.618 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 79.7 m80 -28.51 -75.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 115.649 1.722 . . . . 1.0 115.649 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.35 44.16 0.25 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 115.342 1.608 . . . . 1.0 115.342 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.598 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -146.32 4.06 0.91 Allowed 'General case' 0 C--N 1.299 -1.627 0 C-N-CA 118.62 -1.232 . . . . 1.0 109.242 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 6.7 pttm -62.81 -21.81 66.18 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 115.441 -2.504 . . . . 1.0 106.45 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -97.7 10.81 39.06 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.156 -1.384 . . . . 1.0 110.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.598 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -105.49 -51.28 3.04 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.104 -1.073 . . . . 1.0 108.104 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -98.04 -99.8 0.21 Allowed 'General case' 0 C--N 1.306 -1.288 1 N-CA-C 97.792 -4.892 . . . . 1.0 97.792 179.31 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.467 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 71.1 m -139.82 -47.54 0.45 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 106.433 -1.692 . . . . 1.0 106.433 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -152.81 -61.86 0.15 Allowed 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.018 -1.901 . . . . 1.0 109.152 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.487 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.3 m -112.07 147.51 35.87 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 117.444 2.387 . . . . 1.0 117.444 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.836 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -151.77 -86.85 0.07 Allowed 'General case' 0 CA--C 1.571 1.778 0 CA-C-N 113.183 -1.826 . . . . 1.0 112.099 178.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 7.6 tptp -31.0 -53.42 0.2 Allowed 'General case' 0 N--CA 1.513 2.709 1 N-CA-C 124.131 4.863 . . . . 1.0 124.131 -179.635 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.618 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 3.5 m -113.26 4.98 16.72 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-O 125.505 2.574 . . . . 1.0 112.405 -179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.836 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.278 -2.51 1 CA-C-N 107.977 -4.192 . . . . 1.0 112.703 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.749 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 N-CA-C 104.12 -2.548 . . . . 1.0 104.12 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.524 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -150.56 160.29 43.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.679 -0.859 . . . . 1.0 108.679 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.96 5.8 13.0 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 106.886 -1.524 . . . . 1.0 106.886 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -101.77 2.19 38.14 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.144 -2.169 . . . . 1.0 105.144 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.636 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -157.79 -52.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 114.739 1.385 . . . . 1.0 114.739 178.353 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.4 t -29.3 -49.69 0.09 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 124.833 1.333 . . . . 1.0 111.442 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.0 tppt? -178.33 82.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 110.781 -2.918 . . . . 1.0 108.521 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.636 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 76.2 m80 -32.0 -84.8 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 115.992 1.849 . . . . 1.0 115.992 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -61.95 30.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 118.142 2.645 . . . . 1.0 118.142 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.981 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -146.89 4.24 0.84 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.948 -1.871 . . . . 1.0 105.948 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.674 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 20.0 pttp -56.35 -30.79 63.08 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 117.023 -1.871 . . . . 1.0 107.079 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.574 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 25.5 p90 -85.69 6.39 27.86 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 115.588 -0.733 . . . . 1.0 112.573 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.736 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.3 tpp180 -103.1 -47.61 4.29 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.756 -1.572 . . . . 1.0 106.756 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.736 HD13 ' HB3' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -90.6 -71.79 0.61 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 101.527 -3.508 . . . . 1.0 101.527 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m 178.63 -47.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 106.192 -1.781 . . . . 1.0 106.192 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 61.1 m-85 -158.94 -65.66 0.08 Allowed 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 111.969 -2.378 . . . . 1.0 109.201 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.797 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.5 m -111.24 143.22 42.36 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 110.199 -3.182 . . . . 1.0 112.943 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' CA ' ' HB2' ' A' ' 32' ' ' CYS . 0.8 OUTLIER 179.71 -34.71 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.173 2.286 . . . . 1.0 117.173 179.207 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 1.4 tmtp? -83.96 -53.86 5.27 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 122.245 2.293 . . . . 1.0 109.519 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.6 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 90.2 m -84.41 -4.34 58.85 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 105.004 -2.221 . . . . 1.0 105.004 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.797 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.5 m . . . . . 0 C--N 1.294 -1.84 0 CA-C-N 112.127 -2.306 . . . . 1.0 115.368 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 123.536 1.636 . . . . 1.0 106.925 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.525 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -135.08 161.2 35.98 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 103.478 -2.786 . . . . 1.0 103.478 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.658 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.96 0.26 21.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 104.872 -2.27 . . . . 1.0 104.872 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.554 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -94.52 4.0 54.41 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.924 -1.509 . . . . 1.0 106.924 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.525 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.14 -60.05 0.16 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.084 -0.962 . . . . 1.0 112.589 178.098 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.428 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.8 t -30.92 -47.49 0.1 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.579 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 16.7 tppt? -173.89 74.34 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 109.861 -3.336 . . . . 1.0 112.263 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.501 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 81.0 m80 -29.45 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 116.734 2.124 . . . . 1.0 116.734 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.35 41.29 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.759 2.503 . . . . 1.0 117.759 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -146.92 0.87 0.75 Allowed 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 107.993 -1.114 . . . . 1.0 107.993 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 36.5 pttt -58.16 -28.55 64.84 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 116.184 -2.206 . . . . 1.0 109.585 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -84.57 2.98 38.83 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.902 -1.044 . . . . 1.0 110.189 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -110.27 -47.56 3.28 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 113.878 -1.51 . . . . 1.0 112.519 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.879 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -94.9 -65.49 0.98 Allowed 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 103.552 -2.759 . . . . 1.0 103.552 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.45 ' H ' HD22 ' A' ' 25' ' ' LEU . 0.4 OUTLIER 178.73 -55.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 105.171 -2.159 . . . . 1.0 105.171 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.439 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 33.8 m-85 -157.18 -63.22 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 111.028 -2.806 . . . . 1.0 109.395 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.805 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -102.59 162.12 13.18 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 112.194 -2.276 . . . . 1.0 112.044 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.698 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 8.2 ttp85 177.59 -92.51 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 125.311 1.444 . . . . 1.0 111.897 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.92 -50.85 0.22 Allowed 'General case' 0 N--CA 1.51 2.572 0 N-CA-C 117.945 2.572 . . . . 1.0 117.945 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.428 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 7.5 m -97.56 -2.32 41.99 Favored 'General case' 0 N--CA 1.514 2.754 0 CA-C-N 113.842 -1.526 . . . . 1.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 30.1 m . . . . . 0 C--N 1.28 -2.418 0 CA-C-N 110.8 -2.909 . . . . 1.0 115.833 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.757 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.3 p . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 103.765 -2.68 . . . . 1.0 103.765 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.542 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -151.13 159.67 44.32 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.771 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.47 1.85 15.36 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 105.265 -2.124 . . . . 1.0 105.265 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.539 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.4 OUTLIER -96.63 1.67 51.41 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 105.103 -2.184 . . . . 1.0 105.103 179.337 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.582 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.5 OUTLIER -152.37 -61.1 0.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.078 0.77 . . . . 1.0 113.078 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.7 t -29.4 -54.39 0.14 Allowed 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 124.324 2.012 . . . . 1.0 111.583 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -167.21 75.09 0.15 Allowed 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 110.484 -3.053 . . . . 1.0 111.093 -179.128 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.582 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 79.8 m80 -29.19 -79.66 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.124 1.898 . . . . 1.0 116.124 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.21 36.7 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 119.221 3.045 . . . . 1.0 119.221 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -144.93 1.15 0.98 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.588 -1.245 . . . . 1.0 108.118 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.771 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.2 pttp -58.36 -32.78 68.87 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 116.837 -1.945 . . . . 1.0 110.76 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -80.17 0.52 31.96 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.755 -1.566 . . . . 1.0 109.824 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -111.74 -46.37 3.25 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 114.903 1.446 . . . . 1.0 114.903 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.863 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -89.77 -67.74 0.82 Allowed 'General case' 0 N--CA 1.483 1.196 1 N-CA-C 99.789 -4.152 . . . . 1.0 99.789 179.597 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.38 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.563 -1.643 . . . . 1.0 106.563 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -161.0 -62.37 0.06 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 113.317 -1.765 . . . . 1.0 111.16 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.798 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.53 136.19 52.34 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 111.924 -2.398 . . . . 1.0 110.647 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.524 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -164.75 -50.08 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 116.015 1.857 . . . . 1.0 116.015 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -66.1 -83.54 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.932 -1.107 . . . . 1.0 108.058 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.571 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 14.8 m -59.25 -9.43 2.19 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 122.964 1.364 . . . . 1.0 110.571 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.798 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m . . . . . 0 C--N 1.293 -1.864 0 CA-C-N 112.078 -2.328 . . . . 1.0 116.318 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.782 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 102.975 -2.972 . . . . 1.0 102.975 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.59 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -159.64 138.45 10.8 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 116.058 -1.925 . . . . 1.0 109.109 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -56.39 -12.32 1.62 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 117.907 -1.517 . . . . 1.0 108.193 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.509 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -83.15 4.43 26.59 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.24 -0.913 . . . . 1.0 111.129 179.871 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.59 ' HG3' HG23 ' A' ' 13' ' ' THR . 1.2 mt-30 -156.58 -61.0 0.1 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.597 179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.799 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.1 OUTLIER -36.29 -46.14 0.51 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 113.972 -1.467 . . . . 1.0 113.832 -179.654 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -170.3 70.47 0.06 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.536 -2.575 . . . . 1.0 113.083 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 81.8 m-70 -28.61 -92.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 117.508 2.41 . . . . 1.0 117.508 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.464 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.81 56.92 0.75 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.289 -0.869 . . . . 1.0 113.266 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.474 ' O ' HD22 ' A' ' 25' ' ' LEU . . . -156.36 -9.52 0.1 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.973 -1.467 . . . . 1.0 108.591 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.816 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.3 pttt -54.5 -22.46 12.98 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 118.321 -1.352 . . . . 1.0 111.131 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.513 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 27.7 p90 -93.94 8.01 42.92 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.882 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.1 tpp180 -108.4 -48.37 3.35 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 106.233 -1.765 . . . . 1.0 106.233 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.679 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -93.19 -77.81 0.44 Allowed 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 101.825 -3.398 . . . . 1.0 101.825 179.368 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER 178.99 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.9 -1.519 . . . . 1.0 106.9 179.581 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 50.6 m-85 -163.43 -59.45 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 111.62 -2.536 . . . . 1.0 112.04 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.57 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . 1.2 m -127.19 124.18 38.39 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 119.886 3.291 . . . . 1.0 119.886 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.888 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.4 ttm180 -139.33 -87.41 0.22 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -29.52 -69.81 0.06 Allowed 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 119.386 3.106 . . . . 1.0 119.386 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.799 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 25.3 m -86.65 0.54 54.34 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 125.175 2.417 . . . . 1.0 109.867 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.888 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.351 0 CA-C-N 109.567 -3.47 . . . . 1.0 113.249 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.791 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 108.454 -0.943 . . . . 1.0 108.454 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.498 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -153.49 156.62 38.46 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.506 0.504 . . . . 1.0 110.168 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.714 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -73.56 -4.54 34.67 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.512 -1.292 . . . . 1.0 107.512 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.476 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -93.08 0.38 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.29 -1.374 . . . . 1.0 107.29 179.84 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.536 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -151.67 -60.32 0.17 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.172 0.92 . . . . 1.0 112.844 178.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.1 t -29.77 -50.67 0.11 Allowed 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 122.85 1.31 . . . . 1.0 110.509 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.693 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppp? -172.55 76.73 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 111.062 -2.79 . . . . 1.0 112.506 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.536 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 74.8 m80 -29.73 -81.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 116.09 1.885 . . . . 1.0 116.09 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.66 61.27 1.8 Allowed 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 116.965 2.209 . . . . 1.0 116.965 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.693 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -169.31 -7.03 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 112.107 -2.315 . . . . 1.0 109.599 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.714 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 14.3 pttt -48.49 -54.29 14.8 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 116.497 -2.081 . . . . 1.0 108.906 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -59.85 -4.16 0.66 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 124.723 1.265 . . . . 1.0 113.301 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 -105.18 -41.81 5.46 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.965 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.746 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.06 -65.18 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 1 N-CA-C 99.802 -4.147 . . . . 1.0 99.802 179.192 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 177.66 -59.13 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.532 0 O-C-N 125.968 2.043 . . . . 1.0 106.756 179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -157.15 -64.37 0.1 Allowed 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.484 -2.144 . . . . 1.0 111.738 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -103.93 153.93 20.23 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 112.766 -2.015 . . . . 1.0 107.259 -179.618 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.547 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -178.17 -89.35 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.957 1.303 . . . . 1.0 113.135 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -30.66 -49.67 0.12 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.991 2.589 . . . . 1.0 117.991 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.503 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 44.2 m -104.4 -4.62 22.58 Favored 'General case' 0 N--CA 1.51 2.531 0 CA-C-N 112.786 -2.006 . . . . 1.0 111.303 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 7.0 m . . . . . 0 C--N 1.282 -2.367 0 CA-C-N 111.113 -2.767 . . . . 1.0 114.725 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.717 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.539 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -139.29 151.77 46.71 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.551 -2.018 . . . . 1.0 105.551 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.611 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.22 6.98 4.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.721 -1.992 . . . . 1.0 105.675 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.539 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -95.38 1.4 54.23 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 105.45 -2.056 . . . . 1.0 105.45 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.617 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.28 -62.0 0.1 Allowed 'General case' 0 C--N 1.306 -1.304 0 O-C-N 124.023 0.827 . . . . 1.0 112.08 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -29.79 -44.44 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 O-C-N 124.668 1.23 . . . . 1.0 113.299 -179.162 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.479 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 8.1 tppt? -179.19 72.88 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 112.307 -2.224 . . . . 1.0 110.411 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.617 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.5 m80 -29.13 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 116.825 2.158 . . . . 1.0 116.825 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.6 71.04 4.06 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 123.177 1.465 . . . . 1.0 110.003 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.576 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -167.89 -11.38 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 112.861 -1.972 . . . . 1.0 110.697 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.611 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.0 pttm -47.57 -44.49 26.27 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 118.395 -1.322 . . . . 1.0 109.942 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 42.9 p90 -70.57 1.54 5.07 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.294 -1.321 . . . . 1.0 113.241 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.504 ' NH2' ' HB2' ' A' ' 21' ' ' ALA . 2.9 ttp180 -107.54 -54.74 2.44 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 114.683 -1.144 . . . . 1.0 109.356 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.962 ' HG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -80.09 -71.25 0.46 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 103.596 -2.742 . . . . 1.0 103.596 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m 177.98 -52.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 103.258 -2.867 . . . . 1.0 103.258 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -155.06 -50.89 0.09 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.472 -3.058 . . . . 1.0 109.927 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.518 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.6 m -120.69 146.27 46.6 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 115.295 1.591 . . . . 1.0 115.295 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.962 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -162.85 -31.19 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 116.517 2.043 . . . . 1.0 116.517 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 tptm -100.26 -42.0 6.84 Favored 'General case' 0 N--CA 1.525 3.293 0 N-CA-C 119.601 3.186 . . . . 1.0 119.601 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.643 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 73.2 m -103.69 7.78 37.37 Favored 'General case' 0 N--CA 1.525 3.292 0 CA-C-O 125.598 2.618 . . . . 1.0 109.215 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.747 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.355 1 CA-C-N 108.105 -4.134 . . . . 1.0 112.481 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.814 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 106.708 -1.59 . . . . 1.0 106.708 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.544 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -148.93 156.55 42.44 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 114.833 -1.076 . . . . 1.0 108.547 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.66 -0.67 34.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 105.762 -1.94 . . . . 1.0 105.762 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.544 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -91.59 1.76 56.92 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 105.927 -1.879 . . . . 1.0 105.927 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.682 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.91 -56.63 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 178.439 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.9 t -30.37 -52.87 0.16 Allowed 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 125.699 2.666 . . . . 1.0 111.881 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppm? -168.04 74.26 0.12 Allowed 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 109.92 -3.309 . . . . 1.0 111.601 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.682 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 78.0 m80 -29.66 -79.01 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 114.803 1.408 . . . . 1.0 114.803 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.86 27.68 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 118.462 2.764 . . . . 1.0 118.462 -179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.655 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -141.12 2.91 1.75 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 18.9 pttp -62.88 -21.7 66.17 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 116.879 -1.929 . . . . 1.0 108.78 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -95.79 7.9 45.02 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.472 -1.24 . . . . 1.0 108.681 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.529 HH21 ' HB3' ' A' ' 24' ' ' ARG . 4.5 mtp85 -111.05 -46.95 3.26 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 114.692 -1.14 . . . . 1.0 111.308 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.697 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.22 -88.02 0.25 Allowed 'General case' 0 N--CA 1.485 1.283 1 N-CA-C 96.999 -5.186 . . . . 1.0 96.999 179.177 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 20.2 m -161.49 -46.42 0.04 OUTLIER 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.941 -1.503 . . . . 1.0 106.941 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -162.78 -58.14 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 123.55 1.643 . . . . 1.0 111.736 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.791 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -116.25 131.44 56.94 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 111.078 -2.783 . . . . 1.0 112.745 -179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.557 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 11.9 ttp85 -161.13 -49.63 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 N-CA-C 115.869 1.803 . . . . 1.0 115.869 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 32' ' ' CYS . 3.8 tmtt? -70.17 -79.07 0.07 Allowed 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 117.708 -1.597 . . . . 1.0 107.487 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.595 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -59.49 -9.86 2.85 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 123.491 1.615 . . . . 1.0 109.672 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.814 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 2.5 m . . . . . 0 C--N 1.295 -1.793 0 CA-C-N 111.925 -2.398 . . . . 1.0 116.8 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.774 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.935 0 N-CA-C 103.748 -2.686 . . . . 1.0 103.748 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.637 HG23 ' CG ' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -152.38 143.3 23.0 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 116.881 -1.533 . . . . 1.0 107.924 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -59.07 -13.24 6.29 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 117.67 -1.612 . . . . 1.0 107.022 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -80.98 7.92 9.62 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.538 0.685 . . . . 1.0 110.836 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.791 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -164.8 -62.03 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.05 -1.432 . . . . 1.0 111.614 178.352 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.774 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -33.02 -50.02 0.26 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.874 1.321 . . . . 1.0 110.451 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -161.57 62.29 0.26 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.428 -2.169 . . . . 1.0 115.342 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.791 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 72.8 m80 -29.56 -84.02 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 113.836 1.05 . . . . 1.0 113.836 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.13 71.73 4.62 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 124.51 2.1 . . . . 1.0 108.576 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.583 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . 179.43 -10.0 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 111.81 -2.45 . . . . 1.0 109.43 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.673 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 4.9 pttp -50.12 -45.64 53.12 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 115.617 -2.433 . . . . 1.0 107.621 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -70.57 7.01 1.19 Allowed 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.174 1.176 . . . . 1.0 114.174 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.583 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 3.3 mtp85 -108.73 -45.92 3.74 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.121 -1.066 . . . . 1.0 108.121 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.705 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.75 -62.58 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 105.937 -1.875 . . . . 1.0 105.937 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m 178.55 -55.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 103.29 -2.856 . . . . 1.0 103.29 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -152.56 -60.19 0.15 Allowed 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 111.159 -2.746 . . . . 1.0 108.493 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.524 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.1 m -119.14 148.08 43.47 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 111.655 -2.52 . . . . 1.0 116.537 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.898 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 7.5 tmm_? -176.93 -22.53 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 117.327 2.343 . . . . 1.0 117.327 178.179 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -84.58 -37.98 20.5 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 121.55 1.977 . . . . 1.0 114.405 -179.807 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.741 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 0.8 OUTLIER -103.9 -18.39 14.64 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 123.727 1.727 . . . . 1.0 108.611 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.898 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.316 0 CA-C-N 109.549 -3.478 . . . . 1.0 115.615 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 102.782 -3.044 . . . . 1.0 102.782 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.622 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -147.47 166.96 25.68 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 104.932 -2.247 . . . . 1.0 104.932 179.752 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.698 ' HB1' ' CB ' ' A' ' 22' ' ' LYS . . . -82.09 3.95 24.95 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 106.158 -1.793 . . . . 1.0 106.158 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.516 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.1 OUTLIER -102.0 4.38 39.82 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 113.133 -1.849 . . . . 1.0 106.841 179.616 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.622 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.96 -58.02 0.15 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.107 178.153 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.63 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 3.1 t -36.38 -50.14 0.75 Allowed 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.132 1.444 . . . . 1.0 110.637 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.585 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.74 69.45 0.06 Allowed 'General case' 0 C--N 1.302 -1.478 0 CA-C-N 112.183 -2.281 . . . . 1.0 114.858 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.517 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.4 m80 -29.73 -67.75 0.08 Allowed 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 123.241 1.496 . . . . 1.0 112.095 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -78.88 55.46 1.74 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 116.693 2.108 . . . . 1.0 116.693 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.738 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.28 -4.39 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 111.445 -2.616 . . . . 1.0 108.965 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.698 ' CB ' ' HB1' ' A' ' 14' ' ' ALA . 5.7 pttp -48.91 -53.58 19.03 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 115.784 -2.366 . . . . 1.0 108.122 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 10.8 p90 -61.67 0.83 0.29 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 113.304 -1.771 . . . . 1.0 113.349 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 2.3 mtp85 -109.45 -48.37 3.25 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 114.01 1.115 . . . . 1.0 114.01 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.738 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.3 -63.01 1.51 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 102.147 -3.279 . . . . 1.0 102.147 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 177.6 -58.92 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 102.349 -3.204 . . . . 1.0 102.349 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -157.64 -64.13 0.09 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 111.736 -2.484 . . . . 1.0 114.171 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.774 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.15 122.35 47.51 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.279 1.585 . . . . 1.0 115.279 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.63 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 tmm_? -149.46 -73.33 0.18 Allowed 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 117.946 2.572 . . . . 1.0 117.946 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.75 -31.68 0.86 Allowed 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 117.677 2.473 . . . . 1.0 117.677 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -112.92 -2.29 14.34 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 125.523 1.764 . . . . 1.0 110.333 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 12.2 m . . . . . 0 C--N 1.287 -2.121 0 CA-C-N 112.158 -2.292 . . . . 1.0 115.559 -179.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.812 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 106.122 -1.807 . . . . 1.0 106.122 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.561 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -144.85 158.77 43.68 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.014 -1.476 . . . . 1.0 107.014 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.641 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -80.04 6.35 11.71 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.251 -1.759 . . . . 1.0 106.251 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.529 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -99.85 1.84 43.33 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 104.472 -2.418 . . . . 1.0 104.472 179.255 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.614 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -152.37 -62.26 0.16 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.674 0.99 . . . . 1.0 113.674 178.34 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.5 t -29.67 -48.89 0.09 Allowed 'General case' 0 N--CA 1.507 2.39 0 CA-C-O 123.493 1.616 . . . . 1.0 114.294 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.533 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 14.6 tppt? -174.07 72.0 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 109.997 -3.274 . . . . 1.0 109.15 -179.238 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.614 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.8 m80 -28.99 -77.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 117.394 2.368 . . . . 1.0 117.394 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.98 49.5 0.55 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 116.079 1.881 . . . . 1.0 116.079 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.29 -3.36 0.42 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.443 -0.903 . . . . 1.0 109.208 179.32 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.641 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.0 pttt -57.38 -29.44 64.05 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 116.836 -1.946 . . . . 1.0 110.248 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -84.09 0.72 47.28 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 115.123 -0.944 . . . . 1.0 110.058 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.429 HH21 ' HB3' ' A' ' 24' ' ' ARG . 13.3 mtp85 -107.25 -49.48 3.26 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 114.444 -1.253 . . . . 1.0 112.357 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.808 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -96.1 -62.05 1.34 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 105.231 -2.137 . . . . 1.0 105.231 179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.416 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.2 m 178.77 -54.31 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.218 -1.401 . . . . 1.0 107.218 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.408 ' CG ' ' O ' ' A' ' 26' ' ' SER . 63.7 m-85 -163.24 -61.77 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.67 -1.604 . . . . 1.0 109.37 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.829 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -104.07 153.18 21.19 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 109.278 -3.601 . . . . 1.0 108.664 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.583 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -178.14 -60.09 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 115.2 1.556 . . . . 1.0 115.2 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 32' ' ' CYS . 25.7 tptt -70.56 -74.76 0.13 Allowed 'General case' 0 N--CA 1.519 2.983 0 C-N-CA 118.139 -1.425 . . . . 1.0 108.336 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.479 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 23.9 m -59.95 -10.77 4.45 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.201 1.477 . . . . 1.0 110.355 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.829 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m . . . . . 0 C--N 1.293 -1.882 0 CA-C-N 111.86 -2.427 . . . . 1.0 115.682 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.766 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 104.913 -2.255 . . . . 1.0 104.913 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.553 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -158.4 160.03 36.42 Favored 'General case' 0 C--N 1.296 -1.755 0 C-N-CA 119.363 -0.935 . . . . 1.0 110.082 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.744 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.23 9.5 3.75 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 106.831 -1.544 . . . . 1.0 106.831 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.534 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.3 OUTLIER -108.03 1.99 22.83 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 104.305 -2.48 . . . . 1.0 104.305 179.468 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.603 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -153.01 -62.9 0.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 115.926 -0.579 . . . . 1.0 112.539 178.437 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 31' ' ' THR . 1.6 t -29.09 -57.99 0.14 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 123.827 1.775 . . . . 1.0 111.806 -179.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 17.9 tppt? -165.93 73.53 0.18 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 109.799 -3.364 . . . . 1.0 109.527 -179.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.603 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.9 m80 -28.75 -79.03 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 119.685 3.217 . . . . 1.0 119.685 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.97 49.91 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.798 1.777 . . . . 1.0 115.798 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.735 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.94 -1.51 0.42 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.189 -0.945 . . . . 1.0 108.56 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 19.7 pttt -58.98 -25.41 63.56 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 117.626 -1.63 . . . . 1.0 111.616 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -86.48 0.51 54.07 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.63 -1.168 . . . . 1.0 108.793 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.6 mtp85 -109.93 -48.62 3.18 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.109 -1.405 . . . . 1.0 110.791 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.766 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.92 -69.21 0.75 Allowed 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 103.069 -2.938 . . . . 1.0 103.069 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.416 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 4.0 m 178.92 -49.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 107.039 -1.467 . . . . 1.0 107.039 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.663 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 24.6 m-85 -167.03 -84.17 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 105.696 -1.964 . . . . 1.0 105.696 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -81.48 153.16 27.0 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 115.592 -0.731 . . . . 1.0 111.008 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.531 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 tmm_? -171.52 -90.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.551 1.685 . . . . 1.0 115.551 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.07 -54.08 0.38 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 117.766 2.506 . . . . 1.0 117.766 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.59 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 8.6 m -88.48 -6.21 57.76 Favored 'General case' 0 N--CA 1.514 2.749 0 C-N-CA 125.785 1.634 . . . . 1.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 4.1 m . . . . . 0 C--N 1.287 -2.149 0 CA-C-N 110.817 -2.902 . . . . 1.0 112.182 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.331 0 N-CA-C 107.823 -1.177 . . . . 1.0 107.823 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.55 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -156.06 145.89 21.2 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 116.296 -1.811 . . . . 1.0 108.218 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.66 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -62.88 -7.04 4.36 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 117.753 -1.579 . . . . 1.0 107.565 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.537 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 1.0 OUTLIER -87.88 1.7 53.36 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.372 -0.83 . . . . 1.0 109.362 179.652 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.55 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -153.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.191 0.932 . . . . 1.0 110.531 179.343 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -32.79 -42.06 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 114.506 1.299 . . . . 1.0 114.506 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.2 tppp? 179.9 72.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 126.623 2.452 . . . . 1.0 112.141 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.455 ' HA ' ' O ' ' A' ' 14' ' ' ALA . 65.1 m80 -28.03 -91.67 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.348 2.722 . . . . 1.0 118.348 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 41.19 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.018 1.859 . . . . 1.0 116.018 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.639 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -142.42 -1.52 1.16 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.921 -1.14 . . . . 1.0 107.921 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.66 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 24.6 pttm -54.79 -36.82 65.31 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 117.35 -1.74 . . . . 1.0 109.263 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -79.02 2.11 21.62 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.232 -1.349 . . . . 1.0 111.517 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.7 mtp85 -108.5 -40.16 5.2 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.019 -0.991 . . . . 1.0 111.914 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.728 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.05 -79.21 0.42 Allowed 'General case' 0 N--CA 1.483 1.214 1 N-CA-C 96.77 -5.27 . . . . 1.0 96.77 179.078 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -170.02 -51.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.513 1.133 . . . . 1.0 108.006 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -155.43 -71.37 0.12 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.591 -2.095 . . . . 1.0 107.437 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -115.07 139.93 49.47 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 111.482 -2.599 . . . . 1.0 108.468 -179.745 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.87 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -151.84 -55.47 0.14 Allowed 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 118.426 2.75 . . . . 1.0 118.426 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.551 ' C ' ' H ' ' A' ' 32' ' ' CYS . 21.7 tptp -66.09 -81.95 0.03 OUTLIER 'General case' 0 N--CA 1.527 3.413 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.609 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.722 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.7 m -62.55 -5.11 2.32 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 124.53 2.11 . . . . 1.0 111.517 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.87 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.28 -2.453 0 CA-C-N 109.444 -3.525 . . . . 1.0 112.04 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.872 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 14.5 p . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 123.258 1.504 . . . . 1.0 110.992 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -57.27 140.61 49.4 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 117.434 -1.706 . . . . 1.0 108.397 -179.504 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -49.27 -24.19 1.71 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 124.794 1.309 . . . . 1.0 107.95 178.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.642 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -73.68 9.32 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 120.949 0.404 . . . . 1.0 111.791 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.828 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.31 -59.33 0.15 Allowed 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 108.648 -0.871 . . . . 1.0 108.648 178.615 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.544 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.9 t -40.98 -48.52 3.2 Favored 'General case' 0 N--CA 1.517 2.908 0 CA-C-O 122.818 1.294 . . . . 1.0 111.972 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.32 71.63 0.08 Allowed 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 112.407 -2.179 . . . . 1.0 114.776 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.4 ' NE2' ' O ' ' A' ' 15' ' ' PHE . 74.5 m80 -28.76 -60.59 0.13 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.515 -1.22 . . . . 1.0 113.862 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.0 p -88.98 22.56 2.68 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 121.259 3.8 . . . . 1.0 121.259 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.615 ' HB3' ' CG ' ' A' ' 18' ' ' LYS . . . -140.88 3.77 1.85 Allowed 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 117.245 -1.782 . . . . 1.0 106.901 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -49.98 -55.74 13.44 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 116.169 -2.213 . . . . 1.0 108.423 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.414 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 10.8 p90 -60.78 -13.78 17.34 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 114.284 -1.325 . . . . 1.0 112.694 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -86.71 -42.41 13.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 120.459 -0.496 . . . . 1.0 110.467 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.736 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -89.54 -58.33 2.56 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 103.97 -2.604 . . . . 1.0 103.97 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 178.57 -62.35 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.524 -1.658 . . . . 1.0 106.524 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -150.95 -65.01 0.19 Allowed 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 110.493 -3.048 . . . . 1.0 114.671 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.793 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -101.22 143.52 31.19 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 113.233 -1.803 . . . . 1.0 114.224 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.749 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -167.76 -86.89 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 119.527 3.158 . . . . 1.0 119.527 179.593 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -30.43 0.11 Allowed 'General case' 0 N--CA 1.525 3.32 0 N-CA-C 119.343 3.09 . . . . 1.0 119.343 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.544 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 88.4 m -112.59 -7.74 13.86 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.628 1.571 . . . . 1.0 109.758 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.872 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.3 m . . . . . 0 C--N 1.295 -1.788 0 CA-C-N 111.858 -2.428 . . . . 1.0 113.641 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 100.943 -3.725 . . . . 1.0 100.943 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.59 175.98 7.85 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 113.329 -1.76 . . . . 1.0 110.248 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.602 ' CB ' HD11 ' A' ' 7' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.576 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -111.18 -69.85 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 C-N-CA 120.959 -0.296 . . . . 1.0 111.621 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.576 ' H ' HD13 ' A' ' 4' ' ' ILE . 35.8 t70 -146.29 -126.03 0.07 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 124.056 0.848 . . . . 1.0 109.594 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.49 ' H ' ' CG ' ' A' ' 5' ' ' ASP . 5.2 t -33.41 -24.84 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 C-N-CA 127.739 2.415 . . . . 1.0 116.013 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.889 HD13 ' SG ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER -59.44 163.2 6.91 Favored Pre-proline 0 C--N 1.3 -1.568 0 CA-C-N 115.273 -0.876 . . . . 1.0 113.21 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.542 ' O ' ' N ' ' A' ' 10' ' ' SER . 72.6 Cg_exo -40.34 66.54 0.0 OUTLIER 'Trans proline' 0 N--CA 1.504 2.136 1 C-N-CA 127.078 5.185 . . . . 1.0 115.493 165.573 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' N ' ' O ' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -18.8 66.02 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 117.263 2.32 . . . . 1.0 117.263 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 8' ' ' PRO . 97.4 p -144.14 -101.67 0.11 Allowed 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 114.082 -1.417 . . . . 1.0 110.951 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -132.4 24.52 4.46 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 115.48 1.659 . . . . 1.0 115.48 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.889 ' SG ' HD13 ' A' ' 7' ' ' ILE . 1.1 p -102.23 138.0 39.75 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 106.951 -1.5 . . . . 1.0 106.951 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.631 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -153.61 151.31 29.58 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 117.992 -1.004 . . . . 1.0 110.377 -179.899 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -66.46 -11.05 50.13 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.503 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 0.4 OUTLIER -81.92 2.01 32.58 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.733 -1.21 . . . . 1.0 107.733 179.487 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.631 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.5 -66.97 0.18 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.227 0.955 . . . . 1.0 111.986 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.575 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.8 t -29.57 -44.56 0.04 OUTLIER 'General case' 0 N--CA 1.52 3.032 0 CA-C-O 123.229 1.49 . . . . 1.0 112.951 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -172.21 71.22 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 110.709 -2.951 . . . . 1.0 113.437 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.448 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 60.8 m80 -29.56 -84.44 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 114.841 1.423 . . . . 1.0 114.841 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.83 78.26 2.75 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.727 1.727 . . . . 1.0 110.778 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.658 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.72 -12.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 112.367 -2.197 . . . . 1.0 110.035 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.808 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -54.34 -20.15 6.75 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 118.066 -1.454 . . . . 1.0 113.512 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.532 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 29.6 p90 -96.97 5.06 51.16 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 122.105 0.955 . . . . 1.0 109.659 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.532 ' HD3' ' CE1' ' A' ' 23' ' ' TYR . 11.6 mtp85 -109.49 -48.02 3.3 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.946 -1.479 . . . . 1.0 108.14 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.668 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.78 -79.06 0.37 Allowed 'General case' 0 N--CA 1.481 1.123 1 N-CA-C 98.769 -4.53 . . . . 1.0 98.769 178.989 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.7 m 178.71 -43.81 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.824 -1.547 . . . . 1.0 106.824 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 46.7 m-85 -159.77 -64.5 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.529 -1.668 . . . . 1.0 113.959 -179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -111.53 155.84 22.65 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 112.433 -2.167 . . . . 1.0 111.408 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.7 ttp180 -176.55 -89.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 116.874 2.176 . . . . 1.0 116.874 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -39.9 -42.53 1.35 Allowed 'General case' 0 N--CA 1.521 3.107 0 N-CA-C 116.622 2.082 . . . . 1.0 116.622 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 6.9 m -105.21 1.33 28.1 Favored 'General case' 0 N--CA 1.513 2.689 0 CA-C-O 124.449 2.071 . . . . 1.0 111.843 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 5.0 m -113.25 -11.87 13.16 Favored 'General case' 0 C--N 1.282 -2.363 0 CA-C-N 109.704 -3.407 . . . . 1.0 115.238 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 41.53 21.44 0.06 OUTLIER Glycine 0 N--CA 1.502 3.046 0 CA-C-N 118.418 0.554 . . . . 1.0 113.251 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.2 t -99.0 -37.81 9.23 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 117.736 2.495 . . . . 1.0 117.736 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.536 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 117.943 -1.027 . . . . 1.0 110.033 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.0 t -121.31 -165.49 1.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 118.491 -1.284 . . . . 1.0 108.808 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.603 ' HG1' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.912 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -111.39 -120.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 104.579 -2.378 . . . . 1.0 104.579 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.48 ' N ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -100.58 37.1 1.76 Allowed 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 115.13 -0.941 . . . . 1.0 110.935 -179.816 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.72 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER -94.15 154.95 17.32 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.458 0.647 . . . . 1.0 110.662 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.54 HD13 ' H ' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -59.87 -52.68 71.95 Favored Pre-proline 0 N--CA 1.501 2.079 0 CA-C-N 115.13 -0.941 . . . . 1.0 112.826 -179.502 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.656 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 10.2 Cg_endo -57.48 83.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.487 1.134 0 C-N-CA 122.786 2.324 . . . . 1.0 107.941 165.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.603 ' HA ' ' HG1' ' A' ' 3' ' ' ABA . 0.2 OUTLIER -77.62 54.77 1.24 Allowed 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 112.934 -1.939 . . . . 1.0 110.336 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -121.39 -123.1 0.28 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.083 -2.326 . . . . 1.0 106.486 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.6 78.45 1.79 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.729 -1.952 . . . . 1.0 105.729 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.833 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -135.82 129.13 31.98 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 102.41 -3.181 . . . . 1.0 102.41 179.636 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.546 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -148.92 153.27 37.76 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 113.394 -1.73 . . . . 1.0 109.252 -179.82 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.827 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.72 10.22 4.29 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 105.414 -2.069 . . . . 1.0 105.414 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.558 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -101.95 -0.54 33.66 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 105.233 -2.136 . . . . 1.0 105.233 179.559 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.554 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -158.3 -52.03 0.07 Allowed 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.652 0.612 . . . . 1.0 112.652 178.674 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.0 t -29.86 -55.74 0.17 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 124.952 1.407 . . . . 1.0 110.687 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -168.61 77.87 0.13 Allowed 'General case' 0 N--CA 1.488 1.454 1 O-C-N 129.389 4.18 . . . . 1.0 109.892 -179.607 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.554 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.3 m80 -29.92 -87.84 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.971 2.212 . . . . 1.0 116.971 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.24 77.0 0.25 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 123.245 1.498 . . . . 1.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.696 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.8 -12.8 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.274 -1.785 . . . . 1.0 109.066 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.827 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.9 pttt -55.51 -19.69 10.54 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.163 -1.415 . . . . 1.0 111.725 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -95.97 11.47 33.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.415 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -120.4 -47.32 2.35 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 113.78 -1.555 . . . . 1.0 109.054 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.696 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -91.5 -74.07 0.52 Allowed 'General case' 0 C--N 1.312 -1.026 1 N-CA-C 99.311 -4.329 . . . . 1.0 99.311 179.09 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.01 -50.85 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 123.702 1.715 . . . . 1.0 107.777 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.535 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 62.2 m-85 -161.08 -63.28 0.06 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.296 -3.138 . . . . 1.0 111.901 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.768 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 m -109.82 137.2 47.95 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 113.578 -1.646 . . . . 1.0 114.0 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.533 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 10.1 ttp180 -166.91 -56.4 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 N-CA-C 116.879 2.177 . . . . 1.0 116.879 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -66.25 -79.22 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.62 0 C-N-CA 117.323 -1.751 . . . . 1.0 108.285 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.597 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 59.5 m -59.21 -12.55 5.5 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-O 122.428 1.109 . . . . 1.0 110.257 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.833 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 1.7 m -98.06 -14.85 20.28 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 117.73 2.492 . . . . 1.0 117.73 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 34.53 27.9 0.01 OUTLIER Glycine 0 N--CA 1.504 3.208 0 O-C-N 124.228 0.955 . . . . 1.0 113.53 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.509 HG23 ' N ' ' A' ' 35' ' ' ABA . 15.0 t -100.83 -75.04 0.59 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 117.393 2.368 . . . . 1.0 117.393 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.509 ' N ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 112.691 0.626 . . . . 1.0 112.691 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.75 172.35 12.09 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 106.026 -1.842 . . . . 1.0 106.026 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.751 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.938 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -113.3 -92.45 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 CA-C-O 117.83 -1.081 . . . . 1.0 112.266 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.938 ' H ' HD13 ' A' ' 4' ' ' ILE . 12.3 t70 -120.19 -105.58 0.38 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 115.594 1.701 . . . . 1.0 115.594 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.76 1.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 116.416 2.006 . . . . 1.0 116.416 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.751 HD11 ' HB2' ' A' ' 3' ' ' ABA . 0.0 OUTLIER -81.66 171.56 11.79 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 108.289 -1.004 . . . . 1.0 108.289 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD2' ' SG ' ' A' ' 12' ' ' CYS . 11.5 Cg_endo -56.75 119.31 6.46 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 106.502 -2.153 . . . . 1.0 106.502 168.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -68.55 73.02 0.23 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 123.194 1.473 . . . . 1.0 108.911 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.0 m -147.79 -109.52 0.08 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.488 -1.233 . . . . 1.0 110.236 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.96 37.14 4.2 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 116.422 2.008 . . . . 1.0 116.422 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER -119.65 132.69 55.75 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 105.13 -2.174 . . . . 1.0 105.13 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.658 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -147.97 150.33 33.82 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 117.495 -1.241 . . . . 1.0 109.997 -179.597 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -65.82 -10.84 41.4 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 105.758 -1.942 . . . . 1.0 105.758 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.572 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -81.9 1.7 33.94 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.433 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.658 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -157.34 -60.28 0.09 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.328 1.018 . . . . 1.0 112.432 179.254 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.634 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.7 t -30.61 -45.21 0.06 Allowed 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -174.05 75.21 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 127.86 3.225 . . . . 1.0 113.772 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.459 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 73.8 m-70 -28.8 -94.21 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 118.601 2.815 . . . . 1.0 118.601 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.17 34.71 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.847 1.425 . . . . 1.0 114.847 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.597 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -139.12 0.93 1.98 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 117.857 -1.068 . . . . 1.0 108.318 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.724 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.6 pttp -50.08 -52.34 35.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 116.511 -2.075 . . . . 1.0 108.074 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.434 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 25.3 p90 -62.83 -8.89 7.77 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 114.338 -1.301 . . . . 1.0 112.305 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 mtp85 -97.39 -36.92 10.21 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 118.163 -0.922 . . . . 1.0 110.752 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.711 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -102.03 -58.1 1.94 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.067 -2.197 . . . . 1.0 105.067 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 177.85 -67.56 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 124.44 2.067 . . . . 1.0 106.115 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -157.09 -52.11 0.07 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 108.47 -3.968 . . . . 1.0 112.866 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.778 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -117.93 151.01 38.27 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.383 -1.281 . . . . 1.0 109.143 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.2 tmm_? -167.75 -88.54 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 117.796 2.517 . . . . 1.0 117.796 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HE3' ' OG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -49.96 -22.85 1.7 Allowed 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 117.631 2.456 . . . . 1.0 117.631 -179.316 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.634 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 5.3 m -114.51 -0.49 13.7 Favored 'General case' 0 N--CA 1.513 2.683 0 CA-C-O 124.574 2.13 . . . . 1.0 110.253 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 12' ' ' CYS 0.267 15.5 m -110.39 176.61 4.98 Favored 'General case' 0 C--N 1.285 -2.204 0 CA-C-N 108.87 -3.786 . . . . 1.0 108.956 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.16 34.13 2.49 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 106.393 -2.683 . . . . 1.0 106.393 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.27 -78.41 0.54 Allowed 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 117.287 2.329 . . . . 1.0 117.287 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.488 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 104.913 -2.254 . . . . 1.0 104.913 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.79 -150.53 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 124.964 1.415 . . . . 1.0 110.932 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.746 HD13 ' H ' ' A' ' 5' ' ' ASP 0.295 0.0 OUTLIER -114.65 -120.96 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 N-CA-C 102.113 -3.292 . . . . 1.0 102.113 -179.757 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.746 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.3 OUTLIER -139.0 65.39 1.45 Allowed 'General case' 0 C--N 1.298 -1.656 0 CA-C-O 123.292 1.52 . . . . 1.0 110.946 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.58 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.1 OUTLIER -100.8 -121.78 0.16 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 102.933 -2.988 . . . . 1.0 102.933 179.555 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.405 ' HB ' ' HD3' ' A' ' 8' ' ' PRO . 3.2 mt -111.89 -64.26 0.03 OUTLIER Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 109.252 -0.647 . . . . 1.0 109.252 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.713 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 60.9 Cg_endo -74.27 95.36 0.92 Allowed 'Trans proline' 0 C--N 1.31 -1.449 0 N-CA-C 106.374 -2.202 . . . . 1.0 106.374 -176.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.467 ' NZ ' ' CG ' ' A' ' 5' ' ' ASP . 17.1 tttp -78.41 66.46 3.97 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 123.148 1.452 . . . . 1.0 109.564 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 43.9 m -119.88 -107.87 0.36 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 111.415 -2.629 . . . . 1.0 103.943 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.34 78.48 1.58 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.674 -1.973 . . . . 1.0 105.674 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.837 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -145.02 137.09 25.81 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 104.114 -2.55 . . . . 1.0 104.114 179.357 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.5 HG23 ' OE1' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -158.82 158.0 32.67 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 105.426 -2.064 . . . . 1.0 105.426 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -75.76 -1.71 26.34 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 105.532 -2.025 . . . . 1.0 105.532 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -90.86 2.42 56.16 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 105.867 -1.901 . . . . 1.0 105.867 179.519 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.657 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -154.92 -60.81 0.12 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 112.313 0.486 . . . . 1.0 112.313 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 31' ' ' THR . 2.7 t -31.1 -53.29 0.2 Allowed 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 123.855 1.788 . . . . 1.0 110.33 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.49 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -165.87 71.06 0.14 Allowed 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 111.347 -2.66 . . . . 1.0 113.547 -179.679 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.657 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 79.6 m80 -29.76 -79.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.983 1.105 . . . . 1.0 113.983 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.46 71.6 1.82 Allowed 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 123.981 1.848 . . . . 1.0 113.226 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.791 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.48 -10.81 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 112.27 -2.241 . . . . 1.0 109.68 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.777 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.3 pttt -55.91 -19.26 11.38 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 116.614 -2.034 . . . . 1.0 113.099 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -94.3 2.58 55.84 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 122.083 0.944 . . . . 1.0 110.245 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.431 HH21 ' HB3' ' A' ' 24' ' ' ARG . 3.4 mtp85 -109.46 -46.59 3.52 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 113.462 -1.699 . . . . 1.0 112.341 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.791 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -90.54 -72.19 0.58 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 101.455 -3.535 . . . . 1.0 101.455 179.625 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.7 m 179.58 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.022 -1.473 . . . . 1.0 107.022 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 30.8 m-85 -162.61 -58.64 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 113.241 -1.8 . . . . 1.0 111.302 -179.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.761 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.08 155.41 23.9 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.209 -1.359 . . . . 1.0 109.927 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.566 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 9.5 ttp85 -177.83 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 O-C-N 125.095 1.497 . . . . 1.0 113.539 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -35.65 -44.47 0.32 Allowed 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 119.958 3.318 . . . . 1.0 119.958 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.503 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 24.8 m -101.26 -5.72 25.13 Favored 'General case' 0 N--CA 1.508 2.44 0 CA-C-O 123.454 1.597 . . . . 1.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.837 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 6.7 m -98.88 158.78 15.41 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 110.652 -2.976 . . . . 1.0 115.193 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.06 41.74 2.13 Favored Glycine 0 N--CA 1.492 2.429 0 CA-C-N 111.745 -2.479 . . . . 1.0 110.547 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.407 ' OG1' ' HG3' ' A' ' 35' ' ' ABA . 0.1 OUTLIER -111.33 -79.63 0.58 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 113.807 -1.197 . . . . 1.0 109.351 179.385 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.407 ' HG3' ' OG1' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 . . . . . 0 N--CA 1.505 2.296 0 N-CA-C 101.474 -3.528 . . . . 1.0 101.474 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.61 179.52 6.37 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 113.099 -1.864 . . . . 1.0 107.539 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.874 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -108.92 -89.38 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 106.19 -1.781 . . . . 1.0 106.19 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.874 ' H ' HD13 ' A' ' 4' ' ' ILE . 14.9 t70 -147.16 -87.08 0.09 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.813 1.32 . . . . 1.0 109.703 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -18.01 -103.08 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 119.883 3.29 . . . . 1.0 119.883 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.426 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 2.5 pt -128.58 48.28 3.45 Favored Pre-proline 0 N--CA 1.51 2.574 0 CA-C-N 121.602 2.001 . . . . 1.0 114.066 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' C ' ' H ' ' A' ' 10' ' ' SER . 69.7 Cg_endo -82.28 89.16 1.21 Allowed 'Trans proline' 0 C--N 1.306 -1.68 0 C-N-CA 122.749 2.299 . . . . 1.0 110.02 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -71.04 30.63 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 119.066 -1.053 . . . . 1.0 113.252 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.43 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER 179.97 -110.54 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 C-N-CA 123.427 0.691 . . . . 1.0 109.411 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -131.1 57.53 1.75 Allowed 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.873 -0.517 . . . . 1.0 111.136 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -109.91 132.4 54.19 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.135 -2.172 . . . . 1.0 105.135 179.537 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -147.66 163.37 36.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 179.59 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.92 -1.62 40.14 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 106.111 -1.811 . . . . 1.0 106.111 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.497 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.4 OUTLIER -90.51 1.18 56.95 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 104.609 -2.367 . . . . 1.0 104.609 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.563 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -152.59 -61.34 0.15 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.0 t -29.97 -52.21 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 123.947 1.832 . . . . 1.0 110.303 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.597 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -168.9 79.31 0.13 Allowed 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 110.941 -2.845 . . . . 1.0 112.463 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.563 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 76.2 m80 -29.93 -78.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.782 1.771 . . . . 1.0 115.782 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.17 40.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 118.625 2.824 . . . . 1.0 118.625 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -148.48 2.18 0.63 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.349 -1.47 . . . . 1.0 108.388 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.767 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 22.2 pttm -59.32 -28.96 67.28 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 116.881 -1.928 . . . . 1.0 108.35 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 24' ' ' ARG . 17.5 p90 -87.22 9.01 21.52 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 113.82 -1.536 . . . . 1.0 110.282 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.515 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 4.0 mtp85 -114.62 -49.69 2.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.453 -1.249 . . . . 1.0 110.884 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.733 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.77 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 103.434 -2.802 . . . . 1.0 103.434 179.407 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.455 ' H ' HD22 ' A' ' 25' ' ' LEU . 27.7 m 179.75 -51.91 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 105.431 -2.063 . . . . 1.0 105.431 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.476 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 39.0 m-85 -160.33 -66.12 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.783 -2.008 . . . . 1.0 109.33 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.807 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -103.11 156.96 17.32 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 111.764 -2.471 . . . . 1.0 111.987 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.3 ttm180 179.03 -88.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 115.045 1.498 . . . . 1.0 115.045 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.29 -38.91 1.26 Allowed 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 118.412 2.745 . . . . 1.0 118.412 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 32.1 m -104.41 -5.0 22.1 Favored 'General case' 0 N--CA 1.508 2.425 0 CA-C-O 122.693 1.235 . . . . 1.0 108.025 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 23.7 m -97.35 164.78 12.32 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 112.411 -2.177 . . . . 1.0 116.279 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.34 41.24 2.28 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 108.136 -1.986 . . . . 1.0 108.136 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.505 HG23 ' N ' ' A' ' 35' ' ' ABA . 2.2 t -109.77 -81.74 0.57 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 113.817 -1.192 . . . . 1.0 112.719 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.505 ' N ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.53 ' HA ' ' NH2' ' A' ' 11' ' ' ARG . 1.3 m 179.61 -157.49 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 104.509 -2.404 . . . . 1.0 104.509 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.673 ' HG3' ' H ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.82 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -109.41 -123.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 N-CA-C 107.576 -1.268 . . . . 1.0 107.576 179.635 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.494 ' N ' HG12 ' A' ' 4' ' ' ILE . 29.0 p-10 -105.61 39.24 1.8 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 124.611 1.194 . . . . 1.0 111.919 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.567 HG21 ' SG ' ' A' ' 28' ' ' CYS . 1.7 p -95.77 -153.42 0.4 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.503 -0.748 . . . . 1.0 111.109 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.464 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -101.92 -48.05 0.18 Allowed Pre-proline 0 N--CA 1.505 2.324 0 CA-C-O 119.167 -0.444 . . . . 1.0 111.928 -179.917 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' HG1' ' A' ' 3' ' ' ABA . 42.5 Cg_endo -74.61 130.24 13.51 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 N-CA-C 107.465 -1.783 . . . . 1.0 107.465 165.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.7 pttm -100.67 47.42 0.92 Allowed 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.392 -2.185 . . . . 1.0 107.162 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 m -104.47 -111.6 0.25 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.112 -1.403 . . . . 1.0 108.649 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' NH2' ' HA ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -146.34 69.8 1.21 Allowed 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 105.963 -1.865 . . . . 1.0 105.963 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.811 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -126.86 121.91 33.17 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 105.211 -2.144 . . . . 1.0 105.211 -179.526 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.55 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -148.3 163.59 36.6 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 105.338 -2.097 . . . . 1.0 105.338 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.24 1.96 19.86 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 116.988 -1.885 . . . . 1.0 106.088 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -98.72 1.94 46.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 105.938 -1.875 . . . . 1.0 105.938 179.528 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.552 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 1.0 OUTLIER -150.74 -62.85 0.19 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 123.516 0.51 . . . . 1.0 109.815 178.12 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.662 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -37.79 -51.3 1.27 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 125.075 1.484 . . . . 1.0 111.301 -179.748 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.44 ' CD ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -163.88 68.57 0.18 Allowed 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 116.012 -2.275 . . . . 1.0 114.122 -179.297 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.552 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 76.3 m80 -28.38 -85.16 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 125.034 1.459 . . . . 1.0 114.797 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.465 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.39 46.65 0.27 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 114.375 1.25 . . . . 1.0 114.375 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.622 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . . . -158.48 -0.32 0.09 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.792 -1.549 . . . . 1.0 107.943 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.902 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -56.0 -21.9 23.88 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 116.7 -2.0 . . . . 1.0 111.628 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.58 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 6.6 p90 -94.68 4.0 54.37 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 124.281 0.988 . . . . 1.0 110.662 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.667 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.5 tpp180 -100.76 -49.81 4.05 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.672 -0.862 . . . . 1.0 108.672 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.772 HD12 ' HE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -86.33 -68.87 0.71 Allowed 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 106.654 -1.61 . . . . 1.0 106.654 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.3 m 178.98 -49.83 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 105.19 -2.152 . . . . 1.0 105.19 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 16.2 m-85 -167.27 -50.47 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 109.513 -3.494 . . . . 1.0 109.989 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -116.95 144.31 44.7 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 117.212 2.301 . . . . 1.0 117.212 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.772 ' HE ' HD12 ' A' ' 25' ' ' LEU . 2.3 ttm180 -170.11 -84.99 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 118.271 2.693 . . . . 1.0 118.271 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.3 mmtm -43.94 -23.83 0.11 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 119.425 3.12 . . . . 1.0 119.425 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.662 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 97.0 m -116.91 -8.66 11.27 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 123.795 1.759 . . . . 1.0 108.382 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.811 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.4 m -100.42 166.07 11.13 Favored 'General case' 0 C--N 1.288 -2.066 0 CA-C-N 112.104 -2.316 . . . . 1.0 114.621 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -113.13 40.63 2.46 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 105.456 -3.058 . . . . 1.0 105.456 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 p -95.37 -80.52 0.42 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.83 0.824 . . . . 1.0 111.643 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.205 1 N-CA-C 99.042 -4.429 . . . . 1.0 99.042 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -169.6 2.36 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 118.56 -1.256 . . . . 1.0 110.749 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.52 ' HG1' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.866 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -105.88 -119.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 105.094 -2.187 . . . . 1.0 105.094 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.466 ' N ' HG12 ' A' ' 4' ' ' ILE . 3.6 m-20 -91.75 27.82 1.96 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 124.098 0.874 . . . . 1.0 111.604 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.6 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -81.88 156.98 24.54 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 100.452 -3.907 . . . . 1.0 100.452 179.417 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -43.24 96.04 Favored Pre-proline 0 N--CA 1.513 2.681 0 N-CA-C 117.446 2.387 . . . . 1.0 117.446 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.615 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 89.7 Cg_endo -75.29 108.87 2.81 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 N-CA-C 106.847 -2.02 . . . . 1.0 106.847 -175.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.52 ' HA ' ' HG1' ' A' ' 3' ' ' ABA . 14.6 tttm -78.17 75.61 4.69 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 117.606 -1.638 . . . . 1.0 110.972 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -144.76 -102.56 0.11 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.911 -0.586 . . . . 1.0 109.963 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.1 64.54 1.38 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.52 1.152 . . . . 1.0 110.813 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.777 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -131.52 122.02 25.44 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 113.27 -1.786 . . . . 1.0 107.662 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.579 ' HB ' HD12 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -146.93 155.34 42.21 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 103.12 -2.918 . . . . 1.0 103.12 179.56 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.665 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.7 11.11 3.37 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 116.518 -2.073 . . . . 1.0 105.506 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.525 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -100.76 1.78 40.65 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.786 -1.931 . . . . 1.0 105.786 179.572 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.618 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -155.28 -59.85 0.11 Allowed 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.938 -0.705 . . . . 1.0 110.714 178.568 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.777 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -34.86 -57.82 0.53 Allowed 'General case' 0 N--CA 1.485 1.282 0 O-C-N 125.21 1.569 . . . . 1.0 110.453 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.545 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -162.5 72.06 0.33 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 112.396 -2.184 . . . . 1.0 113.022 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.618 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 79.7 m80 -28.51 -75.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 115.649 1.722 . . . . 1.0 115.649 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.35 44.16 0.25 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 115.342 1.608 . . . . 1.0 115.342 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.598 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -146.32 4.06 0.91 Allowed 'General case' 0 C--N 1.299 -1.627 0 C-N-CA 118.62 -1.232 . . . . 1.0 109.242 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 6.7 pttm -62.81 -21.81 66.18 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 115.441 -2.504 . . . . 1.0 106.45 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -97.7 10.81 39.06 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.156 -1.384 . . . . 1.0 110.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.598 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -105.49 -51.28 3.04 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.104 -1.073 . . . . 1.0 108.104 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -98.04 -99.8 0.21 Allowed 'General case' 0 C--N 1.306 -1.288 1 N-CA-C 97.792 -4.892 . . . . 1.0 97.792 179.31 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.467 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 71.1 m -139.82 -47.54 0.45 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 106.433 -1.692 . . . . 1.0 106.433 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -152.81 -61.86 0.15 Allowed 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.018 -1.901 . . . . 1.0 109.152 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.6 ' SG ' HG21 ' A' ' 6' ' ' THR . 1.3 m -112.07 147.51 35.87 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 117.444 2.387 . . . . 1.0 117.444 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.836 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -151.77 -86.85 0.07 Allowed 'General case' 0 CA--C 1.571 1.778 0 CA-C-N 113.183 -1.826 . . . . 1.0 112.099 178.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 7.6 tptp -31.0 -53.42 0.2 Allowed 'General case' 0 N--CA 1.513 2.709 1 N-CA-C 124.131 4.863 . . . . 1.0 124.131 -179.635 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.618 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 3.5 m -113.26 4.98 16.72 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-O 125.505 2.574 . . . . 1.0 112.405 -179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.836 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -90.18 164.07 14.57 Favored 'General case' 0 C--N 1.278 -2.51 1 CA-C-N 107.977 -4.192 . . . . 1.0 112.703 -179.877 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' H ' ' HG3' ' A' ' 8' ' ' PRO . . . -122.68 35.55 3.4 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 108.399 -1.88 . . . . 1.0 108.399 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.96 -91.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 103.802 -2.666 . . . . 1.0 103.802 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.83 0 N-CA-C 107.655 -1.239 . . . . 1.0 107.655 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -151.82 -151.22 0.38 Allowed 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.92 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -115.97 -96.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.92 ' H ' HD13 ' A' ' 4' ' ' ILE . 3.1 t70 -132.74 -92.84 0.36 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.452 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 26.1 p -18.96 -96.9 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.966 3.321 . . . . 1.0 119.966 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.467 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.3 pt -127.4 41.54 0.72 Allowed Pre-proline 0 N--CA 1.508 2.431 0 N-CA-C 116.712 2.115 . . . . 1.0 116.712 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.467 ' CD ' ' N ' ' A' ' 7' ' ' ILE . 88.0 Cg_endo -78.29 104.34 1.82 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 124.48 3.453 . . . . 1.0 106.933 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -90.31 8.73 31.89 Favored 'General case' 0 N--CA 1.503 2.193 0 CA-C-O 123.166 1.46 . . . . 1.0 113.023 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.6 m -153.08 -110.42 0.04 OUTLIER 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 112.487 -2.142 . . . . 1.0 107.662 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.49 ' NH1' HG21 ' A' ' 31' ' ' THR . 0.0 OUTLIER -134.97 77.25 1.67 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 104.997 -2.223 . . . . 1.0 104.997 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.749 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -121.88 130.08 53.08 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 104.12 -2.548 . . . . 1.0 104.12 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.524 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -150.56 160.29 43.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.679 -0.859 . . . . 1.0 108.679 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.96 5.8 13.0 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 106.886 -1.524 . . . . 1.0 106.886 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -101.77 2.19 38.14 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.144 -2.169 . . . . 1.0 105.144 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.636 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -157.79 -52.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 114.739 1.385 . . . . 1.0 114.739 178.353 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.4 t -29.3 -49.69 0.09 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 124.833 1.333 . . . . 1.0 111.442 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.0 tppt? -178.33 82.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 110.781 -2.918 . . . . 1.0 108.521 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.636 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 76.2 m80 -32.0 -84.8 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 115.992 1.849 . . . . 1.0 115.992 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -61.95 30.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 118.142 2.645 . . . . 1.0 118.142 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.981 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -146.89 4.24 0.84 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.948 -1.871 . . . . 1.0 105.948 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.674 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 20.0 pttp -56.35 -30.79 63.08 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 117.023 -1.871 . . . . 1.0 107.079 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.574 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 25.5 p90 -85.69 6.39 27.86 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 115.588 -0.733 . . . . 1.0 112.573 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.736 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.3 tpp180 -103.1 -47.61 4.29 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.756 -1.572 . . . . 1.0 106.756 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.736 HD13 ' HB3' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -90.6 -71.79 0.61 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 101.527 -3.508 . . . . 1.0 101.527 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m 178.63 -47.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 106.192 -1.781 . . . . 1.0 106.192 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 61.1 m-85 -158.94 -65.66 0.08 Allowed 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 111.969 -2.378 . . . . 1.0 109.201 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.797 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.5 m -111.24 143.22 42.36 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 110.199 -3.182 . . . . 1.0 112.943 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.628 ' HG3' ' C ' ' A' ' 35' ' ' ABA . 0.8 OUTLIER 179.71 -34.71 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.173 2.286 . . . . 1.0 117.173 179.207 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 1.4 tmtp? -83.96 -53.86 5.27 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 122.245 2.293 . . . . 1.0 109.519 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.6 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 90.2 m -84.41 -4.34 58.85 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 105.004 -2.221 . . . . 1.0 105.004 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.797 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.5 m -98.16 -67.03 0.87 Allowed 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 112.127 -2.306 . . . . 1.0 115.368 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.57 9.93 64.07 Favored Glycine 0 N--CA 1.504 3.193 0 N-CA-C 107.921 -2.072 . . . . 1.0 107.921 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 p -70.6 -84.39 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 113.196 -1.502 . . . . 1.0 113.085 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.628 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' HG ' ' A' ' 2' ' ' SER . 25.8 mtp180 . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 101.469 -3.53 . . . . 1.0 101.469 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.42 ' HG ' ' C ' ' A' ' 1' ' ' ARG . 1.1 m -161.14 114.39 1.96 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.609 HD13 ' N ' ' A' ' 5' ' ' ASP . 0.1 OUTLIER -113.46 -48.85 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.222 -1.029 . . . . 1.0 108.222 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.609 ' N ' HD13 ' A' ' 4' ' ' ILE . 4.6 t70 -120.24 -89.6 0.6 Allowed 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 113.714 -1.585 . . . . 1.0 107.863 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.451 HG21 ' HB2' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -46.86 177.58 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 123.787 1.756 . . . . 1.0 115.554 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.0 pt -121.07 77.76 32.26 Favored Pre-proline 0 N--CA 1.501 2.083 0 CA-C-N 113.1 -1.864 . . . . 1.0 113.603 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.621 ' HG3' ' H ' ' A' ' 12' ' ' CYS . 11.5 Cg_endo -86.79 174.92 5.39 Favored 'Trans proline' 0 C--N 1.307 -1.632 1 C-N-CA 125.781 4.321 . . . . 1.0 108.948 168.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -88.08 25.2 1.64 Allowed 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.122 -1.031 . . . . 1.0 111.43 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -174.76 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 N-CA-C 117.689 2.477 . . . . 1.0 117.689 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.07 62.09 1.43 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.43 1.27 . . . . 1.0 114.43 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -96.87 122.35 39.73 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 116.976 -1.89 . . . . 1.0 106.925 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.525 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -135.08 161.2 35.98 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 103.478 -2.786 . . . . 1.0 103.478 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.658 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.96 0.26 21.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 104.872 -2.27 . . . . 1.0 104.872 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.554 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -94.52 4.0 54.41 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.924 -1.509 . . . . 1.0 106.924 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.525 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.14 -60.05 0.16 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.084 -0.962 . . . . 1.0 112.589 178.098 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.428 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.8 t -30.92 -47.49 0.1 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.579 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 16.7 tppt? -173.89 74.34 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 109.861 -3.336 . . . . 1.0 112.263 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.501 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 81.0 m80 -29.45 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 116.734 2.124 . . . . 1.0 116.734 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.35 41.29 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.759 2.503 . . . . 1.0 117.759 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -146.92 0.87 0.75 Allowed 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 107.993 -1.114 . . . . 1.0 107.993 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 36.5 pttt -58.16 -28.55 64.84 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 116.184 -2.206 . . . . 1.0 109.585 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -84.57 2.98 38.83 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.902 -1.044 . . . . 1.0 110.189 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -110.27 -47.56 3.28 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 113.878 -1.51 . . . . 1.0 112.519 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.879 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -94.9 -65.49 0.98 Allowed 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 103.552 -2.759 . . . . 1.0 103.552 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.45 ' H ' HD22 ' A' ' 25' ' ' LEU . 0.4 OUTLIER 178.73 -55.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 105.171 -2.159 . . . . 1.0 105.171 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.439 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 33.8 m-85 -157.18 -63.22 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 111.028 -2.806 . . . . 1.0 109.395 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.805 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -102.59 162.12 13.18 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 112.194 -2.276 . . . . 1.0 112.044 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.698 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 8.2 ttp85 177.59 -92.51 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 125.311 1.444 . . . . 1.0 111.897 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.92 -50.85 0.22 Allowed 'General case' 0 N--CA 1.51 2.572 0 N-CA-C 117.945 2.572 . . . . 1.0 117.945 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.428 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 7.5 m -97.56 -2.32 41.99 Favored 'General case' 0 N--CA 1.514 2.754 0 CA-C-N 113.842 -1.526 . . . . 1.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 30.1 m -100.6 -53.29 3.12 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 110.8 -2.909 . . . . 1.0 115.833 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.51 -7.62 79.76 Favored Glycine 0 N--CA 1.498 2.789 0 C-N-CA 119.946 -1.121 . . . . 1.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -65.03 -45.35 85.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 105.741 -1.948 . . . . 1.0 105.741 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.456 ' C ' ' CG ' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.431 ' N ' ' OE1' ' A' ' 16' ' ' GLN . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 108.158 -1.053 . . . . 1.0 108.158 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -105.34 -154.54 0.51 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 103.584 -2.747 . . . . 1.0 103.584 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.413 ' HB3' ' O ' ' A' ' 8' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.905 HD13 ' N ' ' A' ' 5' ' ' ASP 0.317 0.0 OUTLIER -119.88 -86.8 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 118.632 0.651 . . . . 1.0 112.172 -179.537 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.905 ' N ' HD13 ' A' ' 4' ' ' ILE . 10.9 t70 -118.05 -98.19 0.45 Allowed 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.072 0.949 . . . . 1.0 113.459 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' A' ' 7' ' ' ILE . 0.4 OUTLIER -18.4 -102.91 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 116.113 1.894 . . . . 1.0 116.113 -179.354 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.525 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pp -145.1 26.19 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.267 0 CA-C-N 121.366 1.893 . . . . 1.0 115.553 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.765 ' CB ' ' SG ' ' A' ' 12' ' ' CYS . 19.2 Cg_endo -75.47 109.19 2.86 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 CA-C-N 120.391 1.176 . . . . 1.0 110.774 -168.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -81.68 51.79 1.77 Allowed 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.233 -0.894 . . . . 1.0 109.341 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -156.03 -138.23 0.07 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.136 -0.938 . . . . 1.0 111.516 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.405 ' HB3' HH11 ' A' ' 11' ' ' ARG . 0.0 OUTLIER -125.06 39.96 3.85 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.734 -1.121 . . . . 1.0 108.428 -179.764 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.765 ' SG ' ' CB ' ' A' ' 8' ' ' PRO . 3.3 p -96.75 139.58 32.59 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 103.765 -2.68 . . . . 1.0 103.765 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.542 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -151.13 159.67 44.32 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.771 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.47 1.85 15.36 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 105.265 -2.124 . . . . 1.0 105.265 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.539 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.4 OUTLIER -96.63 1.67 51.41 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 105.103 -2.184 . . . . 1.0 105.103 179.337 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.582 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -152.37 -61.1 0.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.078 0.77 . . . . 1.0 113.078 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.7 t -29.4 -54.39 0.14 Allowed 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 124.324 2.012 . . . . 1.0 111.583 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -167.21 75.09 0.15 Allowed 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 110.484 -3.053 . . . . 1.0 111.093 -179.128 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.582 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 79.8 m80 -29.19 -79.66 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.124 1.898 . . . . 1.0 116.124 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.21 36.7 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 119.221 3.045 . . . . 1.0 119.221 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -144.93 1.15 0.98 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.588 -1.245 . . . . 1.0 108.118 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.771 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.2 pttp -58.36 -32.78 68.87 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 116.837 -1.945 . . . . 1.0 110.76 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -80.17 0.52 31.96 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.755 -1.566 . . . . 1.0 109.824 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -111.74 -46.37 3.25 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 114.903 1.446 . . . . 1.0 114.903 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.863 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -89.77 -67.74 0.82 Allowed 'General case' 0 N--CA 1.483 1.196 1 N-CA-C 99.789 -4.152 . . . . 1.0 99.789 179.597 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.38 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.563 -1.643 . . . . 1.0 106.563 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.519 ' HB3' HD12 ' A' ' 4' ' ' ILE . 45.5 m-85 -161.0 -62.37 0.06 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 113.317 -1.765 . . . . 1.0 111.16 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.798 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.53 136.19 52.34 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 111.924 -2.398 . . . . 1.0 110.647 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.524 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -164.75 -50.08 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 116.015 1.857 . . . . 1.0 116.015 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -66.1 -83.54 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.932 -1.107 . . . . 1.0 108.058 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.571 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 14.8 m -59.25 -9.43 2.19 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 122.964 1.364 . . . . 1.0 110.571 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.798 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m -94.04 -29.53 15.16 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 112.078 -2.328 . . . . 1.0 116.318 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 49.88 22.76 4.68 Favored Glycine 0 N--CA 1.496 2.648 0 O-C-N 124.354 1.034 . . . . 1.0 111.275 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.442 ' OG1' ' HA ' ' A' ' 29' ' ' ARG . 3.8 p -77.01 -73.79 0.28 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 116.243 1.942 . . . . 1.0 116.243 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.502 ' C ' ' HD3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 108.071 -1.085 . . . . 1.0 108.071 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.414 ' OG ' ' N ' ' A' ' 3' ' ' ABA . 26.3 t 179.87 -172.36 0.19 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 104.762 -2.31 . . . . 1.0 104.762 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.414 ' N ' ' OG ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.745 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -118.72 -86.18 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-O 118.2 -0.905 . . . . 1.0 112.595 179.83 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.745 ' H ' HD13 ' A' ' 4' ' ' ILE . 21.0 t70 -118.28 -100.59 0.44 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 115.912 1.819 . . . . 1.0 115.912 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -14.11 62.66 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 115.601 1.704 . . . . 1.0 115.601 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.698 ' HB ' ' SG ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -59.62 164.64 5.21 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 121.454 0.645 . . . . 1.0 112.17 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.578 ' O ' ' N ' ' A' ' 10' ' ' SER . 10.1 Cg_endo -56.31 80.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.313 -1.333 0 C-N-CA 124.262 3.308 . . . . 1.0 111.286 169.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -30.45 67.14 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.449 0 N-CA-C 116.08 1.882 . . . . 1.0 116.08 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 8' ' ' PRO . 48.2 m -147.21 -88.74 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.032 1.123 . . . . 1.0 114.032 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -135.2 40.81 2.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 115.274 1.583 . . . . 1.0 115.274 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.782 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -129.32 137.33 50.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 102.975 -2.972 . . . . 1.0 102.975 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.59 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -159.64 138.45 10.8 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 116.058 -1.925 . . . . 1.0 109.109 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -56.39 -12.32 1.62 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 117.907 -1.517 . . . . 1.0 108.193 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.509 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -83.15 4.43 26.59 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.24 -0.913 . . . . 1.0 111.129 179.871 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.59 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.58 -61.0 0.1 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.597 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.799 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.1 OUTLIER -36.29 -46.14 0.51 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 113.972 -1.467 . . . . 1.0 113.832 -179.654 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -170.3 70.47 0.06 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.536 -2.575 . . . . 1.0 113.083 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 81.8 m-70 -28.61 -92.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 117.508 2.41 . . . . 1.0 117.508 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.464 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.81 56.92 0.75 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.289 -0.869 . . . . 1.0 113.266 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.474 ' O ' HD22 ' A' ' 25' ' ' LEU . . . -156.36 -9.52 0.1 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.973 -1.467 . . . . 1.0 108.591 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.816 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.3 pttt -54.5 -22.46 12.98 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 118.321 -1.352 . . . . 1.0 111.131 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.513 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 27.7 p90 -93.94 8.01 42.92 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.882 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.1 tpp180 -108.4 -48.37 3.35 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 106.233 -1.765 . . . . 1.0 106.233 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.679 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -93.19 -77.81 0.44 Allowed 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 101.825 -3.398 . . . . 1.0 101.825 179.368 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER 178.99 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.9 -1.519 . . . . 1.0 106.9 179.581 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 50.6 m-85 -163.43 -59.45 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 111.62 -2.536 . . . . 1.0 112.04 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.618 ' O ' HG23 ' A' ' 34' ' ' THR . 1.2 m -127.19 124.18 38.39 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 119.886 3.291 . . . . 1.0 119.886 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.888 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.4 ttm180 -139.33 -87.41 0.22 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -29.52 -69.81 0.06 Allowed 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 119.386 3.106 . . . . 1.0 119.386 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.799 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 25.3 m -86.65 0.54 54.34 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 125.175 2.417 . . . . 1.0 109.867 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.888 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -101.39 -16.26 16.94 Favored 'General case' 0 C--N 1.282 -2.351 0 CA-C-N 109.567 -3.47 . . . . 1.0 113.249 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 38.38 24.83 0.03 OUTLIER Glycine 0 N--CA 1.494 2.535 0 O-C-N 125.15 1.531 . . . . 1.0 112.613 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.618 HG23 ' O ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -113.74 -83.45 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.168 2.284 . . . . 1.0 117.168 -179.706 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.435 ' H ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 10' ' ' SER . 3.1 tpp180 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 117.401 -1.285 . . . . 1.0 113.053 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 p -121.84 26.22 8.77 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 120.022 1.283 . . . . 1.0 109.836 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.512 ' HB2' ' HG2' ' A' ' 8' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.481 HG22 ' O ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -101.43 -66.98 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 N-CA-C 106.299 -1.741 . . . . 1.0 106.299 179.856 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.452 ' N ' HD13 ' A' ' 4' ' ' ILE . 3.2 t70 -162.8 -94.88 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.014 0.821 . . . . 1.0 110.01 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.427 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 60.1 p -19.17 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 119.224 3.046 . . . . 1.0 119.224 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.572 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 5.2 pt -128.07 32.68 0.23 Allowed Pre-proline 0 N--CA 1.506 2.357 0 N-CA-C 114.832 1.419 . . . . 1.0 114.832 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 7' ' ' ILE . 72.1 Cg_endo -73.33 72.78 3.44 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 124.821 3.681 . . . . 1.0 109.264 -174.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -62.25 35.85 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 117.905 2.557 . . . . 1.0 117.905 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 1' ' ' ARG . 32.5 p -173.26 -93.26 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 113.846 1.054 . . . . 1.0 113.846 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -145.11 36.83 1.13 Allowed 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 125.638 1.575 . . . . 1.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.791 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -97.67 136.54 37.89 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 118.458 -1.297 . . . . 1.0 108.454 -179.464 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.498 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -153.49 156.62 38.46 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.506 0.504 . . . . 1.0 110.168 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.714 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -73.56 -4.54 34.67 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.512 -1.292 . . . . 1.0 107.512 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.476 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -93.08 0.38 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.29 -1.374 . . . . 1.0 107.29 179.84 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.536 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -151.67 -60.32 0.17 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.172 0.92 . . . . 1.0 112.844 178.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.1 t -29.77 -50.67 0.11 Allowed 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 122.85 1.31 . . . . 1.0 110.509 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.693 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppp? -172.55 76.73 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 111.062 -2.79 . . . . 1.0 112.506 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.536 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 74.8 m80 -29.73 -81.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 116.09 1.885 . . . . 1.0 116.09 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.66 61.27 1.8 Allowed 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 116.965 2.209 . . . . 1.0 116.965 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.693 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -169.31 -7.03 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 112.107 -2.315 . . . . 1.0 109.599 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.714 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 14.3 pttt -48.49 -54.29 14.8 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 116.497 -2.081 . . . . 1.0 108.906 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -59.85 -4.16 0.66 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 124.723 1.265 . . . . 1.0 113.301 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 -105.18 -41.81 5.46 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.965 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.746 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.06 -65.18 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 1 N-CA-C 99.802 -4.147 . . . . 1.0 99.802 179.192 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 177.66 -59.13 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.532 0 O-C-N 125.968 2.043 . . . . 1.0 106.756 179.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -157.15 -64.37 0.1 Allowed 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.484 -2.144 . . . . 1.0 111.738 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -103.93 153.93 20.23 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 112.766 -2.015 . . . . 1.0 107.259 -179.618 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.547 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -178.17 -89.35 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.957 1.303 . . . . 1.0 113.135 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -30.66 -49.67 0.12 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.991 2.589 . . . . 1.0 117.991 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.503 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 44.2 m -104.4 -4.62 22.58 Favored 'General case' 0 N--CA 1.51 2.531 0 CA-C-N 112.786 -2.006 . . . . 1.0 111.303 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 7.0 m -99.97 169.11 9.42 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 111.113 -2.767 . . . . 1.0 114.725 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.11 36.45 3.63 Favored Glycine 0 N--CA 1.501 3.032 0 N-CA-C 109.082 -1.607 . . . . 1.0 109.082 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.54 ' CB ' HD11 ' A' ' 7' ' ' ILE . 11.9 t -109.64 -53.04 2.71 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 115.908 1.818 . . . . 1.0 115.908 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.473 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 . . . . . 0 N--CA 1.507 2.386 0 N-CA-C 101.353 -3.573 . . . . 1.0 101.353 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -139.52 -163.01 1.41 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 110.157 -3.202 . . . . 1.0 106.771 -178.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.608 ' HG2' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.93 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -100.49 -117.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 102.545 -3.132 . . . . 1.0 102.545 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.491 ' H ' HG12 ' A' ' 4' ' ' ILE . 2.1 t70 -81.55 20.87 0.85 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 124.264 0.977 . . . . 1.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 1.057 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -85.3 158.39 20.31 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 117.449 -1.7 . . . . 1.0 110.454 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -52.12 75.81 Favored Pre-proline 0 N--CA 1.51 2.556 0 N-CA-C 113.686 0.995 . . . . 1.0 113.686 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.59 ' CG ' ' H ' ' A' ' 33' ' ' GLY . 1.0 OUTLIER -78.26 91.91 1.17 Allowed 'Trans proline' 0 C--N 1.311 -1.421 0 N-CA-C 102.756 -3.594 . . . . 1.0 102.756 -172.239 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.608 ' HA ' ' HG2' ' A' ' 3' ' ' ABA . 0.4 OUTLIER -68.13 55.42 0.07 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 125.343 1.652 . . . . 1.0 113.512 -179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.454 ' O ' ' N ' ' A' ' 3' ' ' ABA . 25.5 m -127.3 -118.69 0.26 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.798 -2.001 . . . . 1.0 105.825 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.56 72.26 1.38 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 120.015 1.28 . . . . 1.0 111.725 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.717 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -134.17 111.91 10.68 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.736 -1.574 . . . . 1.0 107.534 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.645 ' HB ' HD12 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -139.29 151.77 46.71 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.551 -2.018 . . . . 1.0 105.551 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.611 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.22 6.98 4.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.721 -1.992 . . . . 1.0 105.675 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.539 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -95.38 1.4 54.23 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 105.45 -2.056 . . . . 1.0 105.45 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.617 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.28 -62.0 0.1 Allowed 'General case' 0 C--N 1.306 -1.304 0 O-C-N 124.023 0.827 . . . . 1.0 112.08 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -29.79 -44.44 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 O-C-N 124.668 1.23 . . . . 1.0 113.299 -179.162 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.479 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 8.1 tppt? -179.19 72.88 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 112.307 -2.224 . . . . 1.0 110.411 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.617 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.5 m80 -29.13 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 116.825 2.158 . . . . 1.0 116.825 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.6 71.04 4.06 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 123.177 1.465 . . . . 1.0 110.003 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.576 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -167.89 -11.38 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 112.861 -1.972 . . . . 1.0 110.697 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.611 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.0 pttm -47.57 -44.49 26.27 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 118.395 -1.322 . . . . 1.0 109.942 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 42.9 p90 -70.57 1.54 5.07 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.294 -1.321 . . . . 1.0 113.241 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.504 ' NH2' ' HB2' ' A' ' 21' ' ' ALA . 2.9 ttp180 -107.54 -54.74 2.44 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 114.683 -1.144 . . . . 1.0 109.356 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.962 ' HG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -80.09 -71.25 0.46 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 103.596 -2.742 . . . . 1.0 103.596 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m 177.98 -52.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 103.258 -2.867 . . . . 1.0 103.258 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -155.06 -50.89 0.09 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.472 -3.058 . . . . 1.0 109.927 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 1.057 ' SG ' HG21 ' A' ' 6' ' ' THR . 1.6 m -120.69 146.27 46.6 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 115.295 1.591 . . . . 1.0 115.295 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.962 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -162.85 -31.19 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 116.517 2.043 . . . . 1.0 116.517 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 tptm -100.26 -42.0 6.84 Favored 'General case' 0 N--CA 1.525 3.293 0 N-CA-C 119.601 3.186 . . . . 1.0 119.601 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.643 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 73.2 m -103.69 7.78 37.37 Favored 'General case' 0 N--CA 1.525 3.292 0 CA-C-O 125.598 2.618 . . . . 1.0 109.215 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.747 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -98.67 152.92 19.11 Favored 'General case' 0 C--N 1.282 -2.355 1 CA-C-N 108.105 -4.134 . . . . 1.0 112.481 -179.666 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.59 ' H ' ' CG ' ' A' ' 8' ' ' PRO . . . -116.77 41.94 1.99 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 105.715 -2.954 . . . . 1.0 105.715 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.2 t -124.11 -61.51 1.35 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-N 114.846 -0.677 . . . . 1.0 110.612 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.555 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 . . . . . 0 N--CA 1.505 2.317 0 N-CA-C 101.418 -3.549 . . . . 1.0 101.418 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.35 -142.27 0.15 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 111.423 -2.626 . . . . 1.0 105.975 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.577 ' HG1' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.649 ' CG1' ' H ' ' A' ' 5' ' ' ASP 0.306 0.0 OUTLIER -119.29 -129.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.623 1 N-CA-C 97.287 -5.079 . . . . 1.0 97.287 179.417 . . . . . . . . 5 4 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.649 ' H ' ' CG1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -130.31 67.67 1.47 Allowed 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 107.498 -1.297 . . . . 1.0 107.498 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.556 HG21 ' SG ' ' A' ' 12' ' ' CYS . 5.1 t -101.08 -142.76 0.34 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.423 -1.717 . . . . 1.0 106.59 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.421 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -95.61 -57.34 0.2 Allowed Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 105.964 -1.865 . . . . 1.0 105.964 179.695 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.502 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 17.9 Cg_endo -68.42 82.62 0.51 Allowed 'Trans proline' 0 N--CA 1.488 1.168 0 C-N-CA 121.227 1.285 . . . . 1.0 109.518 170.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.577 ' HA ' ' HG1' ' A' ' 3' ' ' ABA . 13.5 tttt -72.81 69.81 0.95 Allowed 'General case' 0 C--N 1.296 -1.731 0 CA-C-O 122.016 0.912 . . . . 1.0 110.463 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 83.9 p -127.9 -99.67 0.36 Allowed 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 114.607 1.336 . . . . 1.0 114.607 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -135.07 36.71 3.03 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 124.595 1.158 . . . . 1.0 110.472 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.814 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -112.66 134.24 54.28 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 106.708 -1.59 . . . . 1.0 106.708 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.544 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -148.93 156.55 42.44 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 114.833 -1.076 . . . . 1.0 108.547 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.66 -0.67 34.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 105.762 -1.94 . . . . 1.0 105.762 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.544 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -91.59 1.76 56.92 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 105.927 -1.879 . . . . 1.0 105.927 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.682 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.91 -56.63 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 178.439 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.9 t -30.37 -52.87 0.16 Allowed 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 125.699 2.666 . . . . 1.0 111.881 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppm? -168.04 74.26 0.12 Allowed 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 109.92 -3.309 . . . . 1.0 111.601 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.682 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 78.0 m80 -29.66 -79.01 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 114.803 1.408 . . . . 1.0 114.803 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.86 27.68 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 118.462 2.764 . . . . 1.0 118.462 -179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.655 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -141.12 2.91 1.75 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 18.9 pttp -62.88 -21.7 66.17 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 116.879 -1.929 . . . . 1.0 108.78 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -95.79 7.9 45.02 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.472 -1.24 . . . . 1.0 108.681 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.529 HH21 ' HB3' ' A' ' 24' ' ' ARG . 4.5 mtp85 -111.05 -46.95 3.26 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 114.692 -1.14 . . . . 1.0 111.308 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.697 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.22 -88.02 0.25 Allowed 'General case' 0 N--CA 1.485 1.283 1 N-CA-C 96.999 -5.186 . . . . 1.0 96.999 179.177 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 20.2 m -161.49 -46.42 0.04 OUTLIER 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.941 -1.503 . . . . 1.0 106.941 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -162.78 -58.14 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 123.55 1.643 . . . . 1.0 111.736 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.791 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -116.25 131.44 56.94 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 111.078 -2.783 . . . . 1.0 112.745 -179.229 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.557 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 11.9 ttp85 -161.13 -49.63 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 N-CA-C 115.869 1.803 . . . . 1.0 115.869 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 32' ' ' CYS . 3.8 tmtt? -70.17 -79.07 0.07 Allowed 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 117.708 -1.597 . . . . 1.0 107.487 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.595 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -59.49 -9.86 2.85 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 123.491 1.615 . . . . 1.0 109.672 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.814 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 2.5 m -98.73 -16.96 18.77 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 111.925 -2.398 . . . . 1.0 116.8 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 34.4 27.11 0.01 OUTLIER Glycine 0 N--CA 1.502 3.066 0 N-CA-C 115.362 0.905 . . . . 1.0 115.362 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.737 HG23 ' H ' ' A' ' 35' ' ' ABA . 1.8 t -102.09 -88.34 0.39 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 117.265 0.532 . . . . 1.0 110.765 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.737 ' H ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 . . . . . 0 N--CA 1.496 1.857 0 N-CA-C 106.016 -1.846 . . . . 1.0 106.016 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 t 179.95 -168.32 0.11 Allowed 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 105.913 -1.884 . . . . 1.0 105.913 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.714 ' HG3' ' O ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.958 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -107.63 -124.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 106.565 -1.643 . . . . 1.0 106.565 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.478 ' H ' HG12 ' A' ' 4' ' ' ILE . 2.9 m-20 -85.57 35.02 0.59 Allowed 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 113.777 1.029 . . . . 1.0 113.777 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.66 HG21 ' SG ' ' A' ' 12' ' ' CYS . 3.3 m -90.02 -170.15 2.68 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.583 ' N ' HD13 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -91.81 -58.25 0.23 Allowed Pre-proline 0 N--CA 1.502 2.139 0 C-N-CA 119.304 -0.958 . . . . 1.0 111.615 -179.457 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 27.2 Cg_endo -60.05 88.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.229 0 C-N-CA 122.198 1.932 . . . . 1.0 107.665 172.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 71.04 0.15 Allowed 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 121.855 0.836 . . . . 1.0 109.281 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.6 m -140.21 -113.91 0.14 Allowed 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.526 HH21 ' CG2' ' A' ' 31' ' ' THR . 0.0 OUTLIER -127.67 75.05 1.57 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 124.107 0.88 . . . . 1.0 108.687 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.774 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -142.24 123.12 14.4 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 103.748 -2.686 . . . . 1.0 103.748 179.289 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.637 HG23 ' CG ' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -152.38 143.3 23.0 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 116.881 -1.533 . . . . 1.0 107.924 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -59.07 -13.24 6.29 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 117.67 -1.612 . . . . 1.0 107.022 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -80.98 7.92 9.62 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.538 0.685 . . . . 1.0 110.836 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.791 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -164.8 -62.03 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.05 -1.432 . . . . 1.0 111.614 178.352 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.774 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -33.02 -50.02 0.26 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.874 1.321 . . . . 1.0 110.451 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -161.57 62.29 0.26 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.428 -2.169 . . . . 1.0 115.342 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.791 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 72.8 m80 -29.56 -84.02 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 113.836 1.05 . . . . 1.0 113.836 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.13 71.73 4.62 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 124.51 2.1 . . . . 1.0 108.576 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.583 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . 179.43 -10.0 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 111.81 -2.45 . . . . 1.0 109.43 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.673 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 4.9 pttp -50.12 -45.64 53.12 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 115.617 -2.433 . . . . 1.0 107.621 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -70.57 7.01 1.19 Allowed 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.174 1.176 . . . . 1.0 114.174 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.583 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 3.3 mtp85 -108.73 -45.92 3.74 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.121 -1.066 . . . . 1.0 108.121 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.705 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.75 -62.58 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 105.937 -1.875 . . . . 1.0 105.937 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.486 ' HB2' ' HG1' ' A' ' 35' ' ' ABA . 1.1 m 178.55 -55.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 103.29 -2.856 . . . . 1.0 103.29 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -152.56 -60.19 0.15 Allowed 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 111.159 -2.746 . . . . 1.0 108.493 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.524 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.1 m -119.14 148.08 43.47 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 111.655 -2.52 . . . . 1.0 116.537 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.898 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 7.5 tmm_? -176.93 -22.53 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 117.327 2.343 . . . . 1.0 117.327 178.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -84.58 -37.98 20.5 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 121.55 1.977 . . . . 1.0 114.405 -179.807 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.741 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 0.8 OUTLIER -103.9 -18.39 14.64 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 123.727 1.727 . . . . 1.0 108.611 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.898 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.98 -40.33 12.41 Favored 'General case' 0 C--N 1.283 -2.316 0 CA-C-N 109.549 -3.478 . . . . 1.0 115.615 -179.507 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 42.86 33.54 1.68 Allowed Glycine 0 N--CA 1.51 3.576 0 N-CA-C 109.487 -1.445 . . . . 1.0 109.487 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.485 HG22 ' HB2' ' A' ' 32' ' ' CYS . 6.4 t -110.85 -35.27 6.01 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 112.428 -1.886 . . . . 1.0 114.917 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.585 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 103.719 -2.697 . . . . 1.0 103.719 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.57 -157.86 0.84 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 111.409 -2.632 . . . . 1.0 105.754 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.837 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -107.0 -91.06 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 N-CA-C 106.034 -1.839 . . . . 1.0 106.034 179.825 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.837 ' H ' HD13 ' A' ' 4' ' ' ILE . 1.1 t70 -142.77 -92.2 0.12 Allowed 'General case' 0 N--CA 1.487 1.39 0 O-C-N 123.973 0.796 . . . . 1.0 110.435 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.547 ' CB ' HD13 ' A' ' 7' ' ' ILE . 39.7 p -19.41 -93.8 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.053 2.983 . . . . 1.0 119.053 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.618 ' N ' HD13 ' A' ' 7' ' ' ILE . 0.1 OUTLIER -132.73 47.5 2.78 Favored Pre-proline 0 N--CA 1.507 2.392 0 N-CA-C 116.632 2.086 . . . . 1.0 116.632 -179.767 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.431 ' HG3' ' H ' ' A' ' 4' ' ' ILE . 88.3 Cg_endo -78.42 98.02 1.17 Allowed 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.714 2.942 . . . . 1.0 107.688 178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.62 24.38 0.29 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.025 0.917 . . . . 1.0 112.042 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER 179.21 -111.03 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 114.741 -1.118 . . . . 1.0 110.369 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -127.52 57.82 1.5 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.893 0.854 . . . . 1.0 110.954 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -111.88 137.64 49.57 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 102.782 -3.044 . . . . 1.0 102.782 179.465 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.622 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -147.47 166.96 25.68 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 104.932 -2.247 . . . . 1.0 104.932 179.752 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.698 ' HB1' ' CB ' ' A' ' 22' ' ' LYS . . . -82.09 3.95 24.95 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 106.158 -1.793 . . . . 1.0 106.158 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.516 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.1 OUTLIER -102.0 4.38 39.82 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 113.133 -1.849 . . . . 1.0 106.841 179.616 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.622 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.96 -58.02 0.15 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.107 178.153 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.63 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 3.1 t -36.38 -50.14 0.75 Allowed 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.132 1.444 . . . . 1.0 110.637 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.585 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.74 69.45 0.06 Allowed 'General case' 0 C--N 1.302 -1.478 0 CA-C-N 112.183 -2.281 . . . . 1.0 114.858 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.517 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.4 m80 -29.73 -67.75 0.08 Allowed 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 123.241 1.496 . . . . 1.0 112.095 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -78.88 55.46 1.74 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 116.693 2.108 . . . . 1.0 116.693 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.738 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.28 -4.39 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 111.445 -2.616 . . . . 1.0 108.965 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.698 ' CB ' ' HB1' ' A' ' 14' ' ' ALA . 5.7 pttp -48.91 -53.58 19.03 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 115.784 -2.366 . . . . 1.0 108.122 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 10.8 p90 -61.67 0.83 0.29 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 113.304 -1.771 . . . . 1.0 113.349 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 2.3 mtp85 -109.45 -48.37 3.25 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 114.01 1.115 . . . . 1.0 114.01 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.738 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.3 -63.01 1.51 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 102.147 -3.279 . . . . 1.0 102.147 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 177.6 -58.92 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 102.349 -3.204 . . . . 1.0 102.349 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -157.64 -64.13 0.09 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 111.736 -2.484 . . . . 1.0 114.171 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.774 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.15 122.35 47.51 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.279 1.585 . . . . 1.0 115.279 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.63 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 tmm_? -149.46 -73.33 0.18 Allowed 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 117.946 2.572 . . . . 1.0 117.946 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.75 -31.68 0.86 Allowed 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 117.677 2.473 . . . . 1.0 117.677 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -112.92 -2.29 14.34 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 125.523 1.764 . . . . 1.0 110.333 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 12.2 m -107.23 158.32 17.21 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 112.158 -2.292 . . . . 1.0 115.559 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.32 36.49 3.96 Favored Glycine 0 N--CA 1.493 2.447 0 CA-C-N 113.574 -1.648 . . . . 1.0 110.56 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.484 HG21 HG12 ' A' ' 7' ' ' ILE . 0.1 OUTLIER -118.42 -98.21 0.45 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 107.53 -1.285 . . . . 1.0 107.53 179.552 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.442 ' H ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.075 0 N-CA-C 101.457 -3.535 . . . . 1.0 101.457 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.402 ' C ' ' HA ' ' A' ' 11' ' ' ARG . 0.2 OUTLIER -170.6 -169.08 0.76 Allowed 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 103.52 -2.77 . . . . 1.0 103.52 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.719 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -121.05 -82.75 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 N-CA-C 105.224 -2.139 . . . . 1.0 105.224 179.759 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.719 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -139.54 -86.14 0.23 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 124.254 0.971 . . . . 1.0 111.194 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.621 HG22 HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -18.52 -113.1 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 119.628 3.196 . . . . 1.0 119.628 -179.643 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.517 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 pt -129.39 44.68 1.45 Allowed Pre-proline 0 N--CA 1.504 2.234 0 O-C-N 120.914 -1.116 . . . . 1.0 112.532 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.582 ' HB3' ' SG ' ' A' ' 12' ' ' CYS . 83.4 Cg_endo -77.62 90.04 1.28 Allowed 'Trans proline' 0 C--N 1.31 -1.452 0 C-N-CA 123.815 3.01 . . . . 1.0 107.181 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -69.3 32.0 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 114.779 1.4 . . . . 1.0 114.779 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER 179.69 -109.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.697 0.799 . . . . 1.0 109.744 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.402 ' HA ' ' C ' ' A' ' 2' ' ' SER . 1.4 ptp180 -130.88 51.76 2.11 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 121.347 0.594 . . . . 1.0 112.042 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.812 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -99.87 128.1 45.98 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 106.122 -1.807 . . . . 1.0 106.122 179.793 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.561 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -144.85 158.77 43.68 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.014 -1.476 . . . . 1.0 107.014 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.641 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -80.04 6.35 11.71 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.251 -1.759 . . . . 1.0 106.251 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.529 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -99.85 1.84 43.33 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 104.472 -2.418 . . . . 1.0 104.472 179.255 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.614 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -152.37 -62.26 0.16 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.674 0.99 . . . . 1.0 113.674 178.34 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.5 t -29.67 -48.89 0.09 Allowed 'General case' 0 N--CA 1.507 2.39 0 CA-C-O 123.493 1.616 . . . . 1.0 114.294 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.533 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 14.6 tppt? -174.07 72.0 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 109.997 -3.274 . . . . 1.0 109.15 -179.238 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.614 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.8 m80 -28.99 -77.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 117.394 2.368 . . . . 1.0 117.394 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.98 49.5 0.55 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 116.079 1.881 . . . . 1.0 116.079 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.29 -3.36 0.42 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.443 -0.903 . . . . 1.0 109.208 179.32 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.641 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.0 pttt -57.38 -29.44 64.05 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 116.836 -1.946 . . . . 1.0 110.248 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -84.09 0.72 47.28 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 115.123 -0.944 . . . . 1.0 110.058 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.429 HH21 ' HB3' ' A' ' 24' ' ' ARG . 13.3 mtp85 -107.25 -49.48 3.26 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 114.444 -1.253 . . . . 1.0 112.357 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.808 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -96.1 -62.05 1.34 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 105.231 -2.137 . . . . 1.0 105.231 179.833 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.416 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.2 m 178.77 -54.31 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.218 -1.401 . . . . 1.0 107.218 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.408 ' CG ' ' O ' ' A' ' 26' ' ' SER . 63.7 m-85 -163.24 -61.77 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.67 -1.604 . . . . 1.0 109.37 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.829 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -104.07 153.18 21.19 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 109.278 -3.601 . . . . 1.0 108.664 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.583 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -178.14 -60.09 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 115.2 1.556 . . . . 1.0 115.2 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 32' ' ' CYS . 25.7 tptt -70.56 -74.76 0.13 Allowed 'General case' 0 N--CA 1.519 2.983 0 C-N-CA 118.139 -1.425 . . . . 1.0 108.336 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.479 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 23.9 m -59.95 -10.77 4.45 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.201 1.477 . . . . 1.0 110.355 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.829 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m -96.71 -16.41 20.92 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 111.86 -2.427 . . . . 1.0 115.682 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 29.61 33.94 0.01 OUTLIER Glycine 0 N--CA 1.504 3.182 0 O-C-N 125.355 1.659 . . . . 1.0 112.77 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.481 ' N ' ' O ' ' A' ' 32' ' ' CYS . 4.8 t -99.38 -45.67 5.77 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 . . . . . 0 N--CA 1.494 1.74 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.44 ' H ' ' HA ' ' A' ' 5' ' ' ASP . 29.1 t 178.98 -151.94 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 101.918 -3.364 . . . . 1.0 101.918 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.672 ' C ' HD12 ' A' ' 4' ' ' ILE . 0.7 OUTLIER -84.75 -27.24 6.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 CA-C-N 112.36 -2.2 . . . . 1.0 109.293 179.777 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.568 ' HB2' ' HA ' ' A' ' 13' ' ' THR . 8.8 t70 46.82 -76.23 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 CA-C-N 111.058 -2.792 . . . . 1.0 114.145 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.455 HG23 ' HB2' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -101.37 -80.04 0.5 Allowed 'General case' 0 C--N 1.295 -1.789 0 O-C-N 125.327 1.642 . . . . 1.0 109.257 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.71 -63.23 0.03 OUTLIER Pre-proline 0 C--N 1.303 -1.444 0 CA-C-N 113.49 -1.686 . . . . 1.0 111.777 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.579 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 2.9 Cg_exo -62.77 124.65 14.47 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 C-N-CA 123.462 2.775 . . . . 1.0 108.071 -157.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 66.64 8.08 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 103.804 -2.665 . . . . 1.0 103.804 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -125.6 -136.84 0.27 Allowed 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 106.227 -1.768 . . . . 1.0 106.227 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' H ' ' HG2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -137.88 71.62 1.4 Allowed 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.065 -1.828 . . . . 1.0 106.065 179.913 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.766 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER -136.79 136.22 38.67 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 104.913 -2.255 . . . . 1.0 104.913 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.568 ' HA ' ' HB2' ' A' ' 5' ' ' ASP . 0.1 OUTLIER -158.4 160.03 36.42 Favored 'General case' 0 C--N 1.296 -1.755 0 C-N-CA 119.363 -0.935 . . . . 1.0 110.082 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.744 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.23 9.5 3.75 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 106.831 -1.544 . . . . 1.0 106.831 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.534 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.3 OUTLIER -108.03 1.99 22.83 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 104.305 -2.48 . . . . 1.0 104.305 179.468 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.603 ' HA ' ' CE1' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -153.01 -62.9 0.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 115.926 -0.579 . . . . 1.0 112.539 178.437 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 31' ' ' THR . 1.6 t -29.09 -57.99 0.14 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 123.827 1.775 . . . . 1.0 111.806 -179.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 17.9 tppt? -165.93 73.53 0.18 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 109.799 -3.364 . . . . 1.0 109.527 -179.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.603 ' CE1' ' HA ' ' A' ' 16' ' ' GLN . 80.9 m80 -28.75 -79.03 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 119.685 3.217 . . . . 1.0 119.685 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.97 49.91 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.798 1.777 . . . . 1.0 115.798 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.735 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.94 -1.51 0.42 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.189 -0.945 . . . . 1.0 108.56 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 19.7 pttt -58.98 -25.41 63.56 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 117.626 -1.63 . . . . 1.0 111.616 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -86.48 0.51 54.07 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.63 -1.168 . . . . 1.0 108.793 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.6 mtp85 -109.93 -48.62 3.18 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.109 -1.405 . . . . 1.0 110.791 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.766 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.92 -69.21 0.75 Allowed 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 103.069 -2.938 . . . . 1.0 103.069 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.416 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 4.0 m 178.92 -49.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 107.039 -1.467 . . . . 1.0 107.039 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.663 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 24.6 m-85 -167.03 -84.17 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 105.696 -1.964 . . . . 1.0 105.696 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -81.48 153.16 27.0 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 115.592 -0.731 . . . . 1.0 111.008 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.531 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 tmm_? -171.52 -90.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.551 1.685 . . . . 1.0 115.551 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.07 -54.08 0.38 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 117.766 2.506 . . . . 1.0 117.766 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.59 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 8.6 m -88.48 -6.21 57.76 Favored 'General case' 0 N--CA 1.514 2.749 0 C-N-CA 125.785 1.634 . . . . 1.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 4.1 m -102.33 -84.77 0.45 Allowed 'General case' 0 C--N 1.287 -2.149 0 CA-C-N 110.817 -2.902 . . . . 1.0 112.182 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 109.62 -0.52 30.66 Favored Glycine 0 N--CA 1.504 3.173 0 N-CA-C 109.272 -1.531 . . . . 1.0 109.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.427 HG23 ' HG3' ' A' ' 35' ' ' ABA . 10.3 t -72.27 -25.42 61.59 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.899 0.857 . . . . 1.0 108.843 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.441 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 103.48 -2.785 . . . . 1.0 103.48 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -132.34 96.07 3.78 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.005 -1.078 . . . . 1.0 109.08 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.573 HD13 ' N ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -107.25 -35.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 125.803 1.94 . . . . 1.0 112.341 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.573 ' N ' HD13 ' A' ' 4' ' ' ILE . 1.2 t0 56.81 -82.72 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 105.535 -2.024 . . . . 1.0 105.535 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -103.01 -58.95 1.78 Allowed 'General case' 0 C--N 1.299 -1.622 0 O-C-N 123.982 0.801 . . . . 1.0 110.011 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.601 HD12 ' OG1' ' A' ' 34' ' ' THR . 0.0 OUTLIER -131.74 -54.32 0.03 OUTLIER Pre-proline 0 N--CA 1.498 1.943 0 N-CA-C 119.045 2.98 . . . . 1.0 119.045 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.538 ' O ' ' N ' ' A' ' 10' ' ' SER . 5.5 Cg_endo -76.13 55.19 4.45 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 123.509 2.806 . . . . 1.0 116.398 -161.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.444 ' CA ' ' HB ' ' A' ' 4' ' ' ILE . 0.1 OUTLIER -30.56 65.92 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 118.582 2.808 . . . . 1.0 118.582 179.925 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 8' ' ' PRO . 40.6 m -143.52 -97.09 0.11 Allowed 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.347 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -129.77 39.78 3.66 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.343 0.498 . . . . 1.0 112.343 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -122.45 129.33 51.92 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.823 -1.177 . . . . 1.0 107.823 -179.816 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.55 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -156.06 145.89 21.2 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 116.296 -1.811 . . . . 1.0 108.218 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.66 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -62.88 -7.04 4.36 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 117.753 -1.579 . . . . 1.0 107.565 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.537 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 1.0 OUTLIER -87.88 1.7 53.36 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.372 -0.83 . . . . 1.0 109.362 179.652 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.55 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -153.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.191 0.932 . . . . 1.0 110.531 179.343 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -32.79 -42.06 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 114.506 1.299 . . . . 1.0 114.506 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.2 tppp? 179.9 72.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 126.623 2.452 . . . . 1.0 112.141 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.455 ' HA ' ' O ' ' A' ' 14' ' ' ALA . 65.1 m80 -28.03 -91.67 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.348 2.722 . . . . 1.0 118.348 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 41.19 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.018 1.859 . . . . 1.0 116.018 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.639 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -142.42 -1.52 1.16 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.921 -1.14 . . . . 1.0 107.921 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.66 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 24.6 pttm -54.79 -36.82 65.31 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 117.35 -1.74 . . . . 1.0 109.263 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -79.02 2.11 21.62 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.232 -1.349 . . . . 1.0 111.517 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.7 mtp85 -108.5 -40.16 5.2 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.019 -0.991 . . . . 1.0 111.914 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.728 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.05 -79.21 0.42 Allowed 'General case' 0 N--CA 1.483 1.214 1 N-CA-C 96.77 -5.27 . . . . 1.0 96.77 179.078 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -170.02 -51.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.513 1.133 . . . . 1.0 108.006 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -155.43 -71.37 0.12 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.591 -2.095 . . . . 1.0 107.437 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -115.07 139.93 49.47 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 111.482 -2.599 . . . . 1.0 108.468 -179.745 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.87 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -151.84 -55.47 0.14 Allowed 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 118.426 2.75 . . . . 1.0 118.426 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.551 ' C ' ' H ' ' A' ' 32' ' ' CYS . 21.7 tptp -66.09 -81.95 0.03 OUTLIER 'General case' 0 N--CA 1.527 3.413 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.609 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.722 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.7 m -62.55 -5.11 2.32 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 124.53 2.11 . . . . 1.0 111.517 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.87 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.93 -31.55 13.61 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-N 109.444 -3.525 . . . . 1.0 112.04 -179.895 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 38.34 31.6 0.12 Allowed Glycine 0 N--CA 1.507 3.41 0 O-C-N 124.32 1.013 . . . . 1.0 111.247 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.601 ' OG1' HD12 ' A' ' 7' ' ' ILE . 0.6 OUTLIER -108.79 -38.62 5.57 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 113.752 -1.224 . . . . 1.0 112.924 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.553 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.6 ttm180 . . . . . 0 N--CA 1.496 1.851 0 N-CA-C 102.734 -3.061 . . . . 1.0 102.734 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 3' ' ' ABA . 5.6 m -118.66 58.16 0.84 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 125.071 1.482 . . . . 1.0 111.648 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ABA . . . . . 0.553 ' HG3' HG22 ' A' ' 4' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.721 HD13 ' N ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -101.55 -46.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 CA-C-N 112.311 -2.222 . . . . 1.0 110.488 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.721 ' N ' HD13 ' A' ' 4' ' ' ILE . 0.8 OUTLIER 55.44 -76.84 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.189 0 CA-C-N 120.259 1.39 . . . . 1.0 110.432 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -101.55 -106.47 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.082 -1.451 . . . . 1.0 107.082 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.512 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 1.1 pp -140.49 47.16 1.08 Allowed Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.751 ' HG3' ' SG ' ' A' ' 12' ' ' CYS . 29.4 Cg_endo -92.57 154.89 2.94 Favored 'Trans proline' 0 C--N 1.315 -1.225 1 C-N-CA 125.86 4.374 . . . . 1.0 107.416 175.925 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 35.16 2.32 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 113.021 0.748 . . . . 1.0 113.021 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.2 m -141.51 -106.42 0.14 Allowed 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 119.007 2.965 . . . . 1.0 119.007 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 75.24 0.99 Allowed 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 105.855 -1.906 . . . . 1.0 105.855 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.872 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 14.5 p -124.14 42.11 3.33 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 123.258 1.504 . . . . 1.0 110.992 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -57.27 140.61 49.4 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 117.434 -1.706 . . . . 1.0 108.397 -179.504 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -49.27 -24.19 1.71 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 124.794 1.309 . . . . 1.0 107.95 178.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.642 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -73.68 9.32 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 120.949 0.404 . . . . 1.0 111.791 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.828 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.31 -59.33 0.15 Allowed 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 108.648 -0.871 . . . . 1.0 108.648 178.615 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.544 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.9 t -40.98 -48.52 3.2 Favored 'General case' 0 N--CA 1.517 2.908 0 CA-C-O 122.818 1.294 . . . . 1.0 111.972 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.32 71.63 0.08 Allowed 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 112.407 -2.179 . . . . 1.0 114.776 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.4 ' NE2' ' O ' ' A' ' 15' ' ' PHE . 74.5 m80 -28.76 -60.59 0.13 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.515 -1.22 . . . . 1.0 113.862 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.0 p -88.98 22.56 2.68 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 121.259 3.8 . . . . 1.0 121.259 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.615 ' HB3' ' CG ' ' A' ' 18' ' ' LYS . . . -140.88 3.77 1.85 Allowed 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 117.245 -1.782 . . . . 1.0 106.901 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -49.98 -55.74 13.44 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 116.169 -2.213 . . . . 1.0 108.423 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.414 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 10.8 p90 -60.78 -13.78 17.34 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 114.284 -1.325 . . . . 1.0 112.694 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -86.71 -42.41 13.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 120.459 -0.496 . . . . 1.0 110.467 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.736 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -89.54 -58.33 2.56 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 103.97 -2.604 . . . . 1.0 103.97 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 178.57 -62.35 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.524 -1.658 . . . . 1.0 106.524 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -150.95 -65.01 0.19 Allowed 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 110.493 -3.048 . . . . 1.0 114.671 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.793 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -101.22 143.52 31.19 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 113.233 -1.803 . . . . 1.0 114.224 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.749 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -167.76 -86.89 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 119.527 3.158 . . . . 1.0 119.527 179.593 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -30.43 0.11 Allowed 'General case' 0 N--CA 1.525 3.32 0 N-CA-C 119.343 3.09 . . . . 1.0 119.343 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.544 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 88.4 m -112.59 -7.74 13.86 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.628 1.571 . . . . 1.0 109.758 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.872 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.3 m -97.6 124.76 42.0 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 111.858 -2.428 . . . . 1.0 113.641 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.43 47.7 3.67 Favored Glycine 0 N--CA 1.5 2.93 0 C-N-CA 120.157 -1.021 . . . . 1.0 111.944 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.17 -85.41 0.6 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 118.445 -0.788 . . . . 1.0 110.303 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ABA . . . . . 0.563 ' C ' HH11 ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.828 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 106.951 -1.5 . . . . 1.0 106.951 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.631 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -153.61 151.31 29.58 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 117.992 -1.004 . . . . 1.0 110.377 -179.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -66.46 -11.05 50.13 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.522 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -81.92 2.01 32.58 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.733 -1.21 . . . . 1.0 107.733 179.487 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.631 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.5 -66.97 0.18 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.227 0.955 . . . . 1.0 111.986 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.575 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.8 t -29.57 -44.56 0.04 OUTLIER 'General case' 0 N--CA 1.52 3.032 0 CA-C-O 123.229 1.49 . . . . 1.0 112.951 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -172.21 71.22 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 110.709 -2.951 . . . . 1.0 113.437 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.522 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 85.5 m-70 -29.56 -84.44 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 114.841 1.423 . . . . 1.0 114.841 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.83 78.26 2.75 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.727 1.727 . . . . 1.0 110.778 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.658 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.72 -12.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 112.367 -2.197 . . . . 1.0 110.035 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.808 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -54.34 -20.15 6.75 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 118.066 -1.454 . . . . 1.0 113.512 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.532 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 29.6 p90 -96.97 5.06 51.16 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 122.105 0.955 . . . . 1.0 109.659 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.532 ' HD3' ' CE1' ' A' ' 23' ' ' TYR . 11.6 mtp85 -109.49 -48.02 3.3 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.946 -1.479 . . . . 1.0 108.14 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.668 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.78 -79.06 0.37 Allowed 'General case' 0 N--CA 1.481 1.123 1 N-CA-C 98.769 -4.53 . . . . 1.0 98.769 178.989 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.7 m 178.71 -43.81 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.824 -1.547 . . . . 1.0 106.824 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 46.7 m-85 -159.77 -64.5 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.529 -1.668 . . . . 1.0 113.959 -179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -111.53 155.84 22.65 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 112.433 -2.167 . . . . 1.0 111.408 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.7 ttp180 -176.55 -89.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 116.874 2.176 . . . . 1.0 116.874 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -39.9 -42.53 1.35 Allowed 'General case' 0 N--CA 1.521 3.107 0 N-CA-C 116.622 2.082 . . . . 1.0 116.622 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 6.9 m -105.21 1.33 28.1 Favored 'General case' 0 N--CA 1.513 2.689 0 CA-C-O 124.449 2.071 . . . . 1.0 111.843 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 5.0 m . . . . . 0 C--N 1.282 -2.363 0 CA-C-N 109.704 -3.407 . . . . 1.0 115.238 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.833 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 102.41 -3.181 . . . . 1.0 102.41 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.546 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -148.92 153.27 37.76 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 113.394 -1.73 . . . . 1.0 109.252 -179.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.827 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.72 10.22 4.29 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 105.414 -2.069 . . . . 1.0 105.414 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.558 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -101.95 -0.54 33.66 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 105.233 -2.136 . . . . 1.0 105.233 179.559 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.546 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -158.3 -52.03 0.07 Allowed 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.652 0.612 . . . . 1.0 112.652 178.674 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.0 t -29.86 -55.74 0.17 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 124.952 1.407 . . . . 1.0 110.687 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -168.61 77.87 0.13 Allowed 'General case' 0 N--CA 1.488 1.454 1 O-C-N 129.389 4.18 . . . . 1.0 109.892 -179.607 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.544 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -29.92 -87.84 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.971 2.212 . . . . 1.0 116.971 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.24 77.0 0.25 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 123.245 1.498 . . . . 1.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.696 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.8 -12.8 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.274 -1.785 . . . . 1.0 109.066 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.827 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.9 pttt -55.51 -19.69 10.54 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.163 -1.415 . . . . 1.0 111.725 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -95.97 11.47 33.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.415 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -120.4 -47.32 2.35 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 113.78 -1.555 . . . . 1.0 109.054 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.696 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -91.5 -74.07 0.52 Allowed 'General case' 0 C--N 1.312 -1.026 1 N-CA-C 99.311 -4.329 . . . . 1.0 99.311 179.09 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.01 -50.85 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 123.702 1.715 . . . . 1.0 107.777 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.535 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 62.2 m-85 -161.08 -63.28 0.06 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.296 -3.138 . . . . 1.0 111.901 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.768 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 m -109.82 137.2 47.95 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 113.578 -1.646 . . . . 1.0 114.0 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.533 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 10.1 ttp180 -166.91 -56.4 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 N-CA-C 116.879 2.177 . . . . 1.0 116.879 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -66.25 -79.22 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.62 0 C-N-CA 117.323 -1.751 . . . . 1.0 108.285 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.597 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 59.5 m -59.21 -12.55 5.5 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-O 122.428 1.109 . . . . 1.0 110.257 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.833 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 1.7 m . . . . . 0 C--N 1.291 -1.971 0 N-CA-C 117.73 2.492 . . . . 1.0 117.73 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 105.13 -2.174 . . . . 1.0 105.13 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.658 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -147.97 150.33 33.82 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 117.495 -1.241 . . . . 1.0 109.997 -179.597 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -65.82 -10.84 41.4 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 105.758 -1.942 . . . . 1.0 105.758 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.572 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -81.9 1.7 33.94 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.433 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.658 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -157.34 -60.28 0.09 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.328 1.018 . . . . 1.0 112.432 179.254 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.634 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.7 t -30.61 -45.21 0.06 Allowed 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -174.05 75.21 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 127.86 3.225 . . . . 1.0 113.772 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.459 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 73.8 m-70 -28.8 -94.21 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 118.601 2.815 . . . . 1.0 118.601 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.17 34.71 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.847 1.425 . . . . 1.0 114.847 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.597 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -139.12 0.93 1.98 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 117.857 -1.068 . . . . 1.0 108.318 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.724 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.6 pttp -50.08 -52.34 35.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 116.511 -2.075 . . . . 1.0 108.074 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.434 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 25.3 p90 -62.83 -8.89 7.77 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 114.338 -1.301 . . . . 1.0 112.305 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 mtp85 -97.39 -36.92 10.21 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 118.163 -0.922 . . . . 1.0 110.752 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.711 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -102.03 -58.1 1.94 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.067 -2.197 . . . . 1.0 105.067 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 177.85 -67.56 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 124.44 2.067 . . . . 1.0 106.115 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -157.09 -52.11 0.07 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 108.47 -3.968 . . . . 1.0 112.866 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.778 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -117.93 151.01 38.27 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.383 -1.281 . . . . 1.0 109.143 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.52 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.2 tmm_? -167.75 -88.54 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 117.796 2.517 . . . . 1.0 117.796 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HE3' ' OG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -49.96 -22.85 1.7 Allowed 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 117.631 2.456 . . . . 1.0 117.631 -179.316 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.634 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 5.3 m -114.51 -0.49 13.7 Favored 'General case' 0 N--CA 1.513 2.683 0 CA-C-O 124.574 2.13 . . . . 1.0 110.253 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 12' ' ' CYS 0.267 15.5 m . . . . . 0 C--N 1.285 -2.204 0 CA-C-N 108.87 -3.786 . . . . 1.0 108.956 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.837 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 104.114 -2.55 . . . . 1.0 104.114 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.5 HG23 ' OE1' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -158.82 158.0 32.67 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 105.426 -2.064 . . . . 1.0 105.426 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -75.76 -1.71 26.34 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 105.532 -2.025 . . . . 1.0 105.532 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.535 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -90.86 2.42 56.16 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 105.867 -1.901 . . . . 1.0 105.867 179.519 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.5 ' OE1' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -154.92 -60.81 0.12 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 112.313 0.486 . . . . 1.0 112.313 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 31' ' ' THR . 2.7 t -31.1 -53.29 0.2 Allowed 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 123.855 1.788 . . . . 1.0 110.33 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.49 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -165.87 71.06 0.14 Allowed 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 111.347 -2.66 . . . . 1.0 113.547 -179.679 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.535 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.76 -79.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.983 1.105 . . . . 1.0 113.983 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.46 71.6 1.82 Allowed 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 123.981 1.848 . . . . 1.0 113.226 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.791 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.48 -10.81 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 112.27 -2.241 . . . . 1.0 109.68 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.777 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.3 pttt -55.91 -19.26 11.38 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 116.614 -2.034 . . . . 1.0 113.099 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -94.3 2.58 55.84 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 122.083 0.944 . . . . 1.0 110.245 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.431 HH21 ' HB3' ' A' ' 24' ' ' ARG . 3.4 mtp85 -109.46 -46.59 3.52 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 113.462 -1.699 . . . . 1.0 112.341 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.791 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -90.54 -72.19 0.58 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 101.455 -3.535 . . . . 1.0 101.455 179.625 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.7 m 179.58 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.022 -1.473 . . . . 1.0 107.022 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 30.8 m-85 -162.61 -58.64 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 113.241 -1.8 . . . . 1.0 111.302 -179.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.761 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.08 155.41 23.9 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.209 -1.359 . . . . 1.0 109.927 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.566 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 9.5 ttp85 -177.83 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 O-C-N 125.095 1.497 . . . . 1.0 113.539 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -35.65 -44.47 0.32 Allowed 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 119.958 3.318 . . . . 1.0 119.958 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.503 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 24.8 m -101.26 -5.72 25.13 Favored 'General case' 0 N--CA 1.508 2.44 0 CA-C-O 123.454 1.597 . . . . 1.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.837 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 6.7 m . . . . . 0 C--N 1.287 -2.13 0 CA-C-N 110.652 -2.976 . . . . 1.0 115.193 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.873 0 N-CA-C 105.135 -2.172 . . . . 1.0 105.135 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -147.66 163.37 36.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 179.59 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.92 -1.62 40.14 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 106.111 -1.811 . . . . 1.0 106.111 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.528 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -90.51 1.18 56.95 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 104.609 -2.367 . . . . 1.0 104.609 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.59 -61.34 0.15 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.0 t -29.97 -52.21 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 123.947 1.832 . . . . 1.0 110.303 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.597 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -168.9 79.31 0.13 Allowed 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 110.941 -2.845 . . . . 1.0 112.463 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.93 -78.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.782 1.771 . . . . 1.0 115.782 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.17 40.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 118.625 2.824 . . . . 1.0 118.625 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -148.48 2.18 0.63 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.349 -1.47 . . . . 1.0 108.388 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.767 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 22.2 pttm -59.32 -28.96 67.28 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 116.881 -1.928 . . . . 1.0 108.35 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 24' ' ' ARG . 17.5 p90 -87.22 9.01 21.52 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 113.82 -1.536 . . . . 1.0 110.282 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.515 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 4.0 mtp85 -114.62 -49.69 2.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.453 -1.249 . . . . 1.0 110.884 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.733 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.77 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 103.434 -2.802 . . . . 1.0 103.434 179.407 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.455 ' H ' HD22 ' A' ' 25' ' ' LEU . 27.7 m 179.75 -51.91 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 105.431 -2.063 . . . . 1.0 105.431 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.476 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 39.0 m-85 -160.33 -66.12 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.783 -2.008 . . . . 1.0 109.33 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.807 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -103.11 156.96 17.32 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 111.764 -2.471 . . . . 1.0 111.987 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.3 ttm180 179.03 -88.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 115.045 1.498 . . . . 1.0 115.045 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.29 -38.91 1.26 Allowed 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 118.412 2.745 . . . . 1.0 118.412 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 32.1 m -104.41 -5.0 22.1 Favored 'General case' 0 N--CA 1.508 2.425 0 CA-C-O 122.693 1.235 . . . . 1.0 108.025 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 23.7 m . . . . . 0 C--N 1.286 -2.155 0 CA-C-N 112.411 -2.177 . . . . 1.0 116.279 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.811 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.279 0 N-CA-C 105.211 -2.144 . . . . 1.0 105.211 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.55 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -148.3 163.59 36.6 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 105.338 -2.097 . . . . 1.0 105.338 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.24 1.96 19.86 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 116.988 -1.885 . . . . 1.0 106.088 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -98.72 1.94 46.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 105.938 -1.875 . . . . 1.0 105.938 179.528 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.525 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -150.74 -62.85 0.19 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 123.516 0.51 . . . . 1.0 109.815 178.12 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.662 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -37.79 -51.3 1.27 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 125.075 1.484 . . . . 1.0 111.301 -179.748 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.44 ' CD ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -163.88 68.57 0.18 Allowed 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 116.012 -2.275 . . . . 1.0 114.122 -179.297 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.556 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 90.4 m-70 -28.38 -85.16 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 125.034 1.459 . . . . 1.0 114.797 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.465 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.39 46.65 0.27 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 114.375 1.25 . . . . 1.0 114.375 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.622 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . . . -158.48 -0.32 0.09 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.792 -1.549 . . . . 1.0 107.943 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.902 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -56.0 -21.9 23.88 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 116.7 -2.0 . . . . 1.0 111.628 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.58 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 6.6 p90 -94.68 4.0 54.37 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 124.281 0.988 . . . . 1.0 110.662 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.667 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.5 tpp180 -100.76 -49.81 4.05 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.672 -0.862 . . . . 1.0 108.672 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.772 HD12 ' HE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -86.33 -68.87 0.71 Allowed 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 106.654 -1.61 . . . . 1.0 106.654 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.3 m 178.98 -49.83 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 105.19 -2.152 . . . . 1.0 105.19 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 16.2 m-85 -167.27 -50.47 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 109.513 -3.494 . . . . 1.0 109.989 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -116.95 144.31 44.7 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 117.212 2.301 . . . . 1.0 117.212 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.772 ' HE ' HD12 ' A' ' 25' ' ' LEU . 2.3 ttm180 -170.11 -84.99 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 118.271 2.693 . . . . 1.0 118.271 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.3 mmtm -43.94 -23.83 0.11 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 119.425 3.12 . . . . 1.0 119.425 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.662 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 97.0 m -116.91 -8.66 11.27 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 123.795 1.759 . . . . 1.0 108.382 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.811 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.4 m . . . . . 0 C--N 1.288 -2.066 0 CA-C-N 112.104 -2.316 . . . . 1.0 114.621 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.777 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 107.662 -1.236 . . . . 1.0 107.662 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.517 ' C ' ' H ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -146.93 155.34 42.21 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 103.12 -2.918 . . . . 1.0 103.12 179.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.665 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.7 11.11 3.37 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 116.518 -2.073 . . . . 1.0 105.506 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.525 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -100.76 1.78 40.65 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.786 -1.931 . . . . 1.0 105.786 179.572 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.469 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -155.28 -59.85 0.11 Allowed 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.938 -0.705 . . . . 1.0 110.714 178.568 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.777 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -34.86 -57.82 0.53 Allowed 'General case' 0 N--CA 1.485 1.282 0 O-C-N 125.21 1.569 . . . . 1.0 110.453 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.545 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -162.5 72.06 0.33 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 112.396 -2.184 . . . . 1.0 113.022 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.502 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.51 -75.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 115.649 1.722 . . . . 1.0 115.649 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.35 44.16 0.25 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 115.342 1.608 . . . . 1.0 115.342 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.598 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -146.32 4.06 0.91 Allowed 'General case' 0 C--N 1.299 -1.627 0 C-N-CA 118.62 -1.232 . . . . 1.0 109.242 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 6.7 pttm -62.81 -21.81 66.18 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 115.441 -2.504 . . . . 1.0 106.45 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -97.7 10.81 39.06 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.156 -1.384 . . . . 1.0 110.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.598 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -105.49 -51.28 3.04 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.104 -1.073 . . . . 1.0 108.104 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -98.04 -99.8 0.21 Allowed 'General case' 0 C--N 1.306 -1.288 1 N-CA-C 97.792 -4.892 . . . . 1.0 97.792 179.31 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.467 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 71.1 m -139.82 -47.54 0.45 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 106.433 -1.692 . . . . 1.0 106.433 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -152.81 -61.86 0.15 Allowed 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.018 -1.901 . . . . 1.0 109.152 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.487 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.3 m -112.07 147.51 35.87 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 117.444 2.387 . . . . 1.0 117.444 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.836 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -151.77 -86.85 0.07 Allowed 'General case' 0 CA--C 1.571 1.778 0 CA-C-N 113.183 -1.826 . . . . 1.0 112.099 178.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 7.6 tptp -31.0 -53.42 0.2 Allowed 'General case' 0 N--CA 1.513 2.709 1 N-CA-C 124.131 4.863 . . . . 1.0 124.131 -179.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.618 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 3.5 m -113.26 4.98 16.72 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-O 125.505 2.574 . . . . 1.0 112.405 -179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.836 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.278 -2.51 1 CA-C-N 107.977 -4.192 . . . . 1.0 112.703 -179.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.749 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 N-CA-C 104.12 -2.548 . . . . 1.0 104.12 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.524 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -150.56 160.29 43.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.679 -0.859 . . . . 1.0 108.679 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.96 5.8 13.0 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 106.886 -1.524 . . . . 1.0 106.886 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -101.77 2.19 38.14 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.144 -2.169 . . . . 1.0 105.144 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.466 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -157.79 -52.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 114.739 1.385 . . . . 1.0 114.739 178.353 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.4 t -29.3 -49.69 0.09 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 124.833 1.333 . . . . 1.0 111.442 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.0 tppt? -178.33 82.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 110.781 -2.918 . . . . 1.0 108.521 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.509 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.3 m-70 -32.0 -84.8 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 115.992 1.849 . . . . 1.0 115.992 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -61.95 30.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 118.142 2.645 . . . . 1.0 118.142 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.981 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -146.89 4.24 0.84 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.948 -1.871 . . . . 1.0 105.948 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.674 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 20.0 pttp -56.35 -30.79 63.08 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 117.023 -1.871 . . . . 1.0 107.079 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.574 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 25.5 p90 -85.69 6.39 27.86 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 115.588 -0.733 . . . . 1.0 112.573 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.736 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.3 tpp180 -103.1 -47.61 4.29 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.756 -1.572 . . . . 1.0 106.756 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.736 HD13 ' HB3' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -90.6 -71.79 0.61 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 101.527 -3.508 . . . . 1.0 101.527 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m 178.63 -47.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 106.192 -1.781 . . . . 1.0 106.192 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 61.1 m-85 -158.94 -65.66 0.08 Allowed 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 111.969 -2.378 . . . . 1.0 109.201 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.797 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.5 m -111.24 143.22 42.36 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 110.199 -3.182 . . . . 1.0 112.943 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' CA ' ' HB2' ' A' ' 32' ' ' CYS . 0.8 OUTLIER 179.71 -34.71 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.173 2.286 . . . . 1.0 117.173 179.207 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.456 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 1.4 tmtp? -83.96 -53.86 5.27 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 122.245 2.293 . . . . 1.0 109.519 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.6 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 90.2 m -84.41 -4.34 58.85 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 105.004 -2.221 . . . . 1.0 105.004 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.797 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.5 m . . . . . 0 C--N 1.294 -1.84 0 CA-C-N 112.127 -2.306 . . . . 1.0 115.368 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 123.536 1.636 . . . . 1.0 106.925 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.525 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -135.08 161.2 35.98 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 103.478 -2.786 . . . . 1.0 103.478 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.658 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.96 0.26 21.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 104.872 -2.27 . . . . 1.0 104.872 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.59 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -94.52 4.0 54.41 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.924 -1.509 . . . . 1.0 106.924 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.525 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.14 -60.05 0.16 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.084 -0.962 . . . . 1.0 112.589 178.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.428 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.8 t -30.92 -47.49 0.1 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.579 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 16.7 tppt? -173.89 74.34 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 109.861 -3.336 . . . . 1.0 112.263 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.59 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.6 m-70 -29.45 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 116.734 2.124 . . . . 1.0 116.734 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.35 41.29 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.759 2.503 . . . . 1.0 117.759 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -146.92 0.87 0.75 Allowed 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 107.993 -1.114 . . . . 1.0 107.993 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 36.5 pttt -58.16 -28.55 64.84 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 116.184 -2.206 . . . . 1.0 109.585 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -84.57 2.98 38.83 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.902 -1.044 . . . . 1.0 110.189 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -110.27 -47.56 3.28 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 113.878 -1.51 . . . . 1.0 112.519 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.879 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -94.9 -65.49 0.98 Allowed 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 103.552 -2.759 . . . . 1.0 103.552 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.45 ' H ' HD22 ' A' ' 25' ' ' LEU . 0.4 OUTLIER 178.73 -55.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 105.171 -2.159 . . . . 1.0 105.171 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.439 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 33.8 m-85 -157.18 -63.22 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 111.028 -2.806 . . . . 1.0 109.395 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.805 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -102.59 162.12 13.18 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 112.194 -2.276 . . . . 1.0 112.044 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.698 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 8.2 ttp85 177.59 -92.51 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 125.311 1.444 . . . . 1.0 111.897 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.92 -50.85 0.22 Allowed 'General case' 0 N--CA 1.51 2.572 0 N-CA-C 117.945 2.572 . . . . 1.0 117.945 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.428 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 7.5 m -97.56 -2.32 41.99 Favored 'General case' 0 N--CA 1.514 2.754 0 CA-C-N 113.842 -1.526 . . . . 1.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 30.1 m . . . . . 0 C--N 1.28 -2.418 0 CA-C-N 110.8 -2.909 . . . . 1.0 115.833 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.757 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 3.3 p . . . . . 0 N--CA 1.483 1.199 0 N-CA-C 103.765 -2.68 . . . . 1.0 103.765 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.542 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -151.13 159.67 44.32 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.771 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.47 1.85 15.36 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 105.265 -2.124 . . . . 1.0 105.265 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -96.63 1.67 51.41 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 105.103 -2.184 . . . . 1.0 105.103 179.337 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.542 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -61.1 0.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.078 0.77 . . . . 1.0 113.078 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.7 t -29.4 -54.39 0.14 Allowed 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 124.324 2.012 . . . . 1.0 111.583 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -167.21 75.09 0.15 Allowed 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 110.484 -3.053 . . . . 1.0 111.093 -179.128 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.6 m-70 -29.19 -79.66 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.124 1.898 . . . . 1.0 116.124 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.21 36.7 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 119.221 3.045 . . . . 1.0 119.221 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -144.93 1.15 0.98 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.588 -1.245 . . . . 1.0 108.118 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.771 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.2 pttp -58.36 -32.78 68.87 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 116.837 -1.945 . . . . 1.0 110.76 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -80.17 0.52 31.96 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.755 -1.566 . . . . 1.0 109.824 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -111.74 -46.37 3.25 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 114.903 1.446 . . . . 1.0 114.903 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.863 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -89.77 -67.74 0.82 Allowed 'General case' 0 N--CA 1.483 1.196 1 N-CA-C 99.789 -4.152 . . . . 1.0 99.789 179.597 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.38 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.563 -1.643 . . . . 1.0 106.563 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -161.0 -62.37 0.06 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 113.317 -1.765 . . . . 1.0 111.16 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.798 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.53 136.19 52.34 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 111.924 -2.398 . . . . 1.0 110.647 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.524 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -164.75 -50.08 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 116.015 1.857 . . . . 1.0 116.015 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -66.1 -83.54 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.932 -1.107 . . . . 1.0 108.058 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.571 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 14.8 m -59.25 -9.43 2.19 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 122.964 1.364 . . . . 1.0 110.571 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.798 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m . . . . . 0 C--N 1.293 -1.864 0 CA-C-N 112.078 -2.328 . . . . 1.0 116.318 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.782 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 102.975 -2.972 . . . . 1.0 102.975 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.59 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -159.64 138.45 10.8 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 116.058 -1.925 . . . . 1.0 109.109 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -56.39 -12.32 1.62 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 117.907 -1.517 . . . . 1.0 108.193 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.509 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -83.15 4.43 26.59 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.24 -0.913 . . . . 1.0 111.129 179.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.59 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.58 -61.0 0.1 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.597 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.799 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.1 OUTLIER -36.29 -46.14 0.51 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 113.972 -1.467 . . . . 1.0 113.832 -179.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -170.3 70.47 0.06 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.536 -2.575 . . . . 1.0 113.083 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 81.8 m-70 -28.61 -92.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 117.508 2.41 . . . . 1.0 117.508 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.464 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.81 56.92 0.75 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.289 -0.869 . . . . 1.0 113.266 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.474 ' O ' HD22 ' A' ' 25' ' ' LEU . . . -156.36 -9.52 0.1 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.973 -1.467 . . . . 1.0 108.591 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.816 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.3 pttt -54.5 -22.46 12.98 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 118.321 -1.352 . . . . 1.0 111.131 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.513 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 27.7 p90 -93.94 8.01 42.92 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.882 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.1 tpp180 -108.4 -48.37 3.35 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 106.233 -1.765 . . . . 1.0 106.233 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.679 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -93.19 -77.81 0.44 Allowed 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 101.825 -3.398 . . . . 1.0 101.825 179.368 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER 178.99 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.9 -1.519 . . . . 1.0 106.9 179.581 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 50.6 m-85 -163.43 -59.45 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 111.62 -2.536 . . . . 1.0 112.04 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.57 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . 1.2 m -127.19 124.18 38.39 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 119.886 3.291 . . . . 1.0 119.886 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.888 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.4 ttm180 -139.33 -87.41 0.22 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -29.52 -69.81 0.06 Allowed 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 119.386 3.106 . . . . 1.0 119.386 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.799 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 25.3 m -86.65 0.54 54.34 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 125.175 2.417 . . . . 1.0 109.867 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.888 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.351 0 CA-C-N 109.567 -3.47 . . . . 1.0 113.249 -179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.791 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 108.454 -0.943 . . . . 1.0 108.454 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.498 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -153.49 156.62 38.46 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.506 0.504 . . . . 1.0 110.168 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.714 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -73.56 -4.54 34.67 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.512 -1.292 . . . . 1.0 107.512 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -93.08 0.38 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.29 -1.374 . . . . 1.0 107.29 179.84 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.498 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.67 -60.32 0.17 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.172 0.92 . . . . 1.0 112.844 178.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.1 t -29.77 -50.67 0.11 Allowed 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 122.85 1.31 . . . . 1.0 110.509 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.693 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppp? -172.55 76.73 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 111.062 -2.79 . . . . 1.0 112.506 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.551 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.8 m-70 -29.73 -81.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 116.09 1.885 . . . . 1.0 116.09 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.66 61.27 1.8 Allowed 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 116.965 2.209 . . . . 1.0 116.965 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.693 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -169.31 -7.03 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 112.107 -2.315 . . . . 1.0 109.599 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.714 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 14.3 pttt -48.49 -54.29 14.8 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 116.497 -2.081 . . . . 1.0 108.906 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -59.85 -4.16 0.66 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 124.723 1.265 . . . . 1.0 113.301 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 -105.18 -41.81 5.46 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.965 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.746 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.06 -65.18 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 1 N-CA-C 99.802 -4.147 . . . . 1.0 99.802 179.192 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 177.66 -59.13 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.532 0 O-C-N 125.968 2.043 . . . . 1.0 106.756 179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -157.15 -64.37 0.1 Allowed 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.484 -2.144 . . . . 1.0 111.738 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -103.93 153.93 20.23 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 112.766 -2.015 . . . . 1.0 107.259 -179.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.547 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -178.17 -89.35 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.957 1.303 . . . . 1.0 113.135 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -30.66 -49.67 0.12 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.991 2.589 . . . . 1.0 117.991 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.503 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 44.2 m -104.4 -4.62 22.58 Favored 'General case' 0 N--CA 1.51 2.531 0 CA-C-N 112.786 -2.006 . . . . 1.0 111.303 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 7.0 m . . . . . 0 C--N 1.282 -2.367 0 CA-C-N 111.113 -2.767 . . . . 1.0 114.725 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.717 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.539 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -139.29 151.77 46.71 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.551 -2.018 . . . . 1.0 105.551 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.611 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.22 6.98 4.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.721 -1.992 . . . . 1.0 105.675 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.539 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -95.38 1.4 54.23 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 105.45 -2.056 . . . . 1.0 105.45 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.492 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.28 -62.0 0.1 Allowed 'General case' 0 C--N 1.306 -1.304 0 O-C-N 124.023 0.827 . . . . 1.0 112.08 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -29.79 -44.44 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 O-C-N 124.668 1.23 . . . . 1.0 113.299 -179.162 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.479 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 8.1 tppt? -179.19 72.88 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 112.307 -2.224 . . . . 1.0 110.411 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.506 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 84.9 m-70 -29.13 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 116.825 2.158 . . . . 1.0 116.825 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.6 71.04 4.06 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 123.177 1.465 . . . . 1.0 110.003 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.576 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -167.89 -11.38 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 112.861 -1.972 . . . . 1.0 110.697 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.611 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.0 pttm -47.57 -44.49 26.27 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 118.395 -1.322 . . . . 1.0 109.942 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 42.9 p90 -70.57 1.54 5.07 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.294 -1.321 . . . . 1.0 113.241 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.504 ' NH2' ' HB2' ' A' ' 21' ' ' ALA . 2.9 ttp180 -107.54 -54.74 2.44 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 114.683 -1.144 . . . . 1.0 109.356 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.962 ' HG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -80.09 -71.25 0.46 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 103.596 -2.742 . . . . 1.0 103.596 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m 177.98 -52.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 103.258 -2.867 . . . . 1.0 103.258 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -155.06 -50.89 0.09 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.472 -3.058 . . . . 1.0 109.927 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.518 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.6 m -120.69 146.27 46.6 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 115.295 1.591 . . . . 1.0 115.295 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.962 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -162.85 -31.19 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 116.517 2.043 . . . . 1.0 116.517 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 tptm -100.26 -42.0 6.84 Favored 'General case' 0 N--CA 1.525 3.293 0 N-CA-C 119.601 3.186 . . . . 1.0 119.601 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.643 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 73.2 m -103.69 7.78 37.37 Favored 'General case' 0 N--CA 1.525 3.292 0 CA-C-O 125.598 2.618 . . . . 1.0 109.215 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.747 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.282 -2.355 1 CA-C-N 108.105 -4.134 . . . . 1.0 112.481 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.814 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 106.708 -1.59 . . . . 1.0 106.708 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.544 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -148.93 156.55 42.44 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 114.833 -1.076 . . . . 1.0 108.547 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.66 -0.67 34.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 105.762 -1.94 . . . . 1.0 105.762 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.544 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -91.59 1.76 56.92 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 105.927 -1.879 . . . . 1.0 105.927 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.482 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.91 -56.63 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 178.439 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.9 t -30.37 -52.87 0.16 Allowed 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 125.699 2.666 . . . . 1.0 111.881 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppm? -168.04 74.26 0.12 Allowed 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 109.92 -3.309 . . . . 1.0 111.601 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.482 ' NE2' ' HA ' ' A' ' 16' ' ' GLN . 92.1 m-70 -29.66 -79.01 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 114.803 1.408 . . . . 1.0 114.803 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.86 27.68 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 118.462 2.764 . . . . 1.0 118.462 -179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.655 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -141.12 2.91 1.75 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 18.9 pttp -62.88 -21.7 66.17 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 116.879 -1.929 . . . . 1.0 108.78 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -95.79 7.9 45.02 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.472 -1.24 . . . . 1.0 108.681 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.529 HH21 ' HB3' ' A' ' 24' ' ' ARG . 4.5 mtp85 -111.05 -46.95 3.26 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 114.692 -1.14 . . . . 1.0 111.308 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.697 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.22 -88.02 0.25 Allowed 'General case' 0 N--CA 1.485 1.283 1 N-CA-C 96.999 -5.186 . . . . 1.0 96.999 179.177 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 20.2 m -161.49 -46.42 0.04 OUTLIER 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.941 -1.503 . . . . 1.0 106.941 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -162.78 -58.14 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 123.55 1.643 . . . . 1.0 111.736 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.791 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -116.25 131.44 56.94 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 111.078 -2.783 . . . . 1.0 112.745 -179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.557 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 11.9 ttp85 -161.13 -49.63 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 N-CA-C 115.869 1.803 . . . . 1.0 115.869 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 32' ' ' CYS . 3.8 tmtt? -70.17 -79.07 0.07 Allowed 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 117.708 -1.597 . . . . 1.0 107.487 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.595 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -59.49 -9.86 2.85 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 123.491 1.615 . . . . 1.0 109.672 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.814 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 2.5 m . . . . . 0 C--N 1.295 -1.793 0 CA-C-N 111.925 -2.398 . . . . 1.0 116.8 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.774 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.935 0 N-CA-C 103.748 -2.686 . . . . 1.0 103.748 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.637 HG23 ' CG ' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -152.38 143.3 23.0 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 116.881 -1.533 . . . . 1.0 107.924 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -59.07 -13.24 6.29 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 117.67 -1.612 . . . . 1.0 107.022 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -80.98 7.92 9.62 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.538 0.685 . . . . 1.0 110.836 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.637 ' CG ' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -164.8 -62.03 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.05 -1.432 . . . . 1.0 111.614 178.352 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.774 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -33.02 -50.02 0.26 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.874 1.321 . . . . 1.0 110.451 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -161.57 62.29 0.26 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.428 -2.169 . . . . 1.0 115.342 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.592 ' NE2' ' HA ' ' A' ' 16' ' ' GLN . 91.7 m-70 -29.56 -84.02 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 113.836 1.05 . . . . 1.0 113.836 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.13 71.73 4.62 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 124.51 2.1 . . . . 1.0 108.576 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.583 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . 179.43 -10.0 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 111.81 -2.45 . . . . 1.0 109.43 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.673 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 4.9 pttp -50.12 -45.64 53.12 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 115.617 -2.433 . . . . 1.0 107.621 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -70.57 7.01 1.19 Allowed 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.174 1.176 . . . . 1.0 114.174 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.583 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 3.3 mtp85 -108.73 -45.92 3.74 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.121 -1.066 . . . . 1.0 108.121 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.705 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.75 -62.58 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 105.937 -1.875 . . . . 1.0 105.937 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.1 m 178.55 -55.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 103.29 -2.856 . . . . 1.0 103.29 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -152.56 -60.19 0.15 Allowed 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 111.159 -2.746 . . . . 1.0 108.493 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.524 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.1 m -119.14 148.08 43.47 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 111.655 -2.52 . . . . 1.0 116.537 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.898 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 7.5 tmm_? -176.93 -22.53 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 117.327 2.343 . . . . 1.0 117.327 178.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -84.58 -37.98 20.5 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 121.55 1.977 . . . . 1.0 114.405 -179.807 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.741 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 0.8 OUTLIER -103.9 -18.39 14.64 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 123.727 1.727 . . . . 1.0 108.611 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.898 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.283 -2.316 0 CA-C-N 109.549 -3.478 . . . . 1.0 115.615 -179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 102.782 -3.044 . . . . 1.0 102.782 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.622 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -147.47 166.96 25.68 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 104.932 -2.247 . . . . 1.0 104.932 179.752 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.698 ' HB1' ' CB ' ' A' ' 22' ' ' LYS . . . -82.09 3.95 24.95 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 106.158 -1.793 . . . . 1.0 106.158 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.582 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -102.0 4.38 39.82 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 113.133 -1.849 . . . . 1.0 106.841 179.616 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.622 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.96 -58.02 0.15 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.107 178.153 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.63 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 3.1 t -36.38 -50.14 0.75 Allowed 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.132 1.444 . . . . 1.0 110.637 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.585 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.74 69.45 0.06 Allowed 'General case' 0 C--N 1.302 -1.478 0 CA-C-N 112.183 -2.281 . . . . 1.0 114.858 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.582 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.5 m-70 -29.73 -67.75 0.08 Allowed 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 123.241 1.496 . . . . 1.0 112.095 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -78.88 55.46 1.74 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 116.693 2.108 . . . . 1.0 116.693 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.738 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.28 -4.39 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 111.445 -2.616 . . . . 1.0 108.965 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.698 ' CB ' ' HB1' ' A' ' 14' ' ' ALA . 5.7 pttp -48.91 -53.58 19.03 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 115.784 -2.366 . . . . 1.0 108.122 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 10.8 p90 -61.67 0.83 0.29 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 113.304 -1.771 . . . . 1.0 113.349 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 2.3 mtp85 -109.45 -48.37 3.25 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 114.01 1.115 . . . . 1.0 114.01 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.738 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.3 -63.01 1.51 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 102.147 -3.279 . . . . 1.0 102.147 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 177.6 -58.92 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 102.349 -3.204 . . . . 1.0 102.349 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -157.64 -64.13 0.09 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 111.736 -2.484 . . . . 1.0 114.171 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.774 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.15 122.35 47.51 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.279 1.585 . . . . 1.0 115.279 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.63 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 tmm_? -149.46 -73.33 0.18 Allowed 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 117.946 2.572 . . . . 1.0 117.946 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.75 -31.68 0.86 Allowed 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 117.677 2.473 . . . . 1.0 117.677 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -112.92 -2.29 14.34 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 125.523 1.764 . . . . 1.0 110.333 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 12.2 m . . . . . 0 C--N 1.287 -2.121 0 CA-C-N 112.158 -2.292 . . . . 1.0 115.559 -179.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.812 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 106.122 -1.807 . . . . 1.0 106.122 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.561 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -144.85 158.77 43.68 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.014 -1.476 . . . . 1.0 107.014 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.641 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -80.04 6.35 11.71 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.251 -1.759 . . . . 1.0 106.251 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.557 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -99.85 1.84 43.33 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 104.472 -2.418 . . . . 1.0 104.472 179.255 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.561 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -62.26 0.16 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.674 0.99 . . . . 1.0 113.674 178.34 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.5 t -29.67 -48.89 0.09 Allowed 'General case' 0 N--CA 1.507 2.39 0 CA-C-O 123.493 1.616 . . . . 1.0 114.294 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.533 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 14.6 tppt? -174.07 72.0 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 109.997 -3.274 . . . . 1.0 109.15 -179.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.557 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 80.0 m-70 -28.99 -77.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 117.394 2.368 . . . . 1.0 117.394 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.98 49.5 0.55 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 116.079 1.881 . . . . 1.0 116.079 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.29 -3.36 0.42 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.443 -0.903 . . . . 1.0 109.208 179.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.641 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.0 pttt -57.38 -29.44 64.05 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 116.836 -1.946 . . . . 1.0 110.248 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -84.09 0.72 47.28 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 115.123 -0.944 . . . . 1.0 110.058 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.429 HH21 ' HB3' ' A' ' 24' ' ' ARG . 13.3 mtp85 -107.25 -49.48 3.26 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 114.444 -1.253 . . . . 1.0 112.357 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.808 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -96.1 -62.05 1.34 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 105.231 -2.137 . . . . 1.0 105.231 179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.416 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.2 m 178.77 -54.31 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.218 -1.401 . . . . 1.0 107.218 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.408 ' CG ' ' O ' ' A' ' 26' ' ' SER . 63.7 m-85 -163.24 -61.77 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.67 -1.604 . . . . 1.0 109.37 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.829 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -104.07 153.18 21.19 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 109.278 -3.601 . . . . 1.0 108.664 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.583 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -178.14 -60.09 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 115.2 1.556 . . . . 1.0 115.2 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 32' ' ' CYS . 25.7 tptt -70.56 -74.76 0.13 Allowed 'General case' 0 N--CA 1.519 2.983 0 C-N-CA 118.139 -1.425 . . . . 1.0 108.336 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.479 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 23.9 m -59.95 -10.77 4.45 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.201 1.477 . . . . 1.0 110.355 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.829 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m . . . . . 0 C--N 1.293 -1.882 0 CA-C-N 111.86 -2.427 . . . . 1.0 115.682 -179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.766 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 104.913 -2.255 . . . . 1.0 104.913 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.553 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -158.4 160.03 36.42 Favored 'General case' 0 C--N 1.296 -1.755 0 C-N-CA 119.363 -0.935 . . . . 1.0 110.082 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.744 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.23 9.5 3.75 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 106.831 -1.544 . . . . 1.0 106.831 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.562 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -108.03 1.99 22.83 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 104.305 -2.48 . . . . 1.0 104.305 179.468 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.553 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -153.01 -62.9 0.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 115.926 -0.579 . . . . 1.0 112.539 178.437 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 31' ' ' THR . 1.6 t -29.09 -57.99 0.14 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 123.827 1.775 . . . . 1.0 111.806 -179.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 17.9 tppt? -165.93 73.53 0.18 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 109.799 -3.364 . . . . 1.0 109.527 -179.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.562 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.9 m-70 -28.75 -79.03 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 119.685 3.217 . . . . 1.0 119.685 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.97 49.91 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.798 1.777 . . . . 1.0 115.798 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.735 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.94 -1.51 0.42 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.189 -0.945 . . . . 1.0 108.56 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 19.7 pttt -58.98 -25.41 63.56 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 117.626 -1.63 . . . . 1.0 111.616 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -86.48 0.51 54.07 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.63 -1.168 . . . . 1.0 108.793 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.6 mtp85 -109.93 -48.62 3.18 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.109 -1.405 . . . . 1.0 110.791 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.766 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.92 -69.21 0.75 Allowed 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 103.069 -2.938 . . . . 1.0 103.069 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.416 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 4.0 m 178.92 -49.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 107.039 -1.467 . . . . 1.0 107.039 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.663 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 24.6 m-85 -167.03 -84.17 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 105.696 -1.964 . . . . 1.0 105.696 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -81.48 153.16 27.0 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 115.592 -0.731 . . . . 1.0 111.008 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.531 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 tmm_? -171.52 -90.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.551 1.685 . . . . 1.0 115.551 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.07 -54.08 0.38 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 117.766 2.506 . . . . 1.0 117.766 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.59 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 8.6 m -88.48 -6.21 57.76 Favored 'General case' 0 N--CA 1.514 2.749 0 C-N-CA 125.785 1.634 . . . . 1.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 4.1 m . . . . . 0 C--N 1.287 -2.149 0 CA-C-N 110.817 -2.902 . . . . 1.0 112.182 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.331 0 N-CA-C 107.823 -1.177 . . . . 1.0 107.823 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.55 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -156.06 145.89 21.2 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 116.296 -1.811 . . . . 1.0 108.218 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.66 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -62.88 -7.04 4.36 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 117.753 -1.579 . . . . 1.0 107.565 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.537 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 1.0 OUTLIER -87.88 1.7 53.36 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.372 -0.83 . . . . 1.0 109.362 179.652 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.55 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -153.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.191 0.932 . . . . 1.0 110.531 179.343 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -32.79 -42.06 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 114.506 1.299 . . . . 1.0 114.506 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.2 tppp? 179.9 72.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 126.623 2.452 . . . . 1.0 112.141 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.03 -91.67 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.348 2.722 . . . . 1.0 118.348 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 41.19 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.018 1.859 . . . . 1.0 116.018 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.639 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -142.42 -1.52 1.16 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.921 -1.14 . . . . 1.0 107.921 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.66 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 24.6 pttm -54.79 -36.82 65.31 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 117.35 -1.74 . . . . 1.0 109.263 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -79.02 2.11 21.62 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.232 -1.349 . . . . 1.0 111.517 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.7 mtp85 -108.5 -40.16 5.2 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.019 -0.991 . . . . 1.0 111.914 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.728 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.05 -79.21 0.42 Allowed 'General case' 0 N--CA 1.483 1.214 1 N-CA-C 96.77 -5.27 . . . . 1.0 96.77 179.078 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -170.02 -51.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.513 1.133 . . . . 1.0 108.006 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -155.43 -71.37 0.12 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.591 -2.095 . . . . 1.0 107.437 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -115.07 139.93 49.47 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 111.482 -2.599 . . . . 1.0 108.468 -179.745 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.87 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -151.84 -55.47 0.14 Allowed 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 118.426 2.75 . . . . 1.0 118.426 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.551 ' C ' ' H ' ' A' ' 32' ' ' CYS . 21.7 tptp -66.09 -81.95 0.03 OUTLIER 'General case' 0 N--CA 1.527 3.413 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.609 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.722 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.7 m -62.55 -5.11 2.32 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 124.53 2.11 . . . . 1.0 111.517 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.87 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.28 -2.453 0 CA-C-N 109.444 -3.525 . . . . 1.0 112.04 -179.895 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.872 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 14.5 p . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 123.258 1.504 . . . . 1.0 110.992 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -57.27 140.61 49.4 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 117.434 -1.706 . . . . 1.0 108.397 -179.504 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -49.27 -24.19 1.71 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 124.794 1.309 . . . . 1.0 107.95 178.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.642 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -73.68 9.32 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 120.949 0.404 . . . . 1.0 111.791 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.828 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.31 -59.33 0.15 Allowed 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 108.648 -0.871 . . . . 1.0 108.648 178.615 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.544 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.9 t -40.98 -48.52 3.2 Favored 'General case' 0 N--CA 1.517 2.908 0 CA-C-O 122.818 1.294 . . . . 1.0 111.972 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.32 71.63 0.08 Allowed 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 112.407 -2.179 . . . . 1.0 114.776 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.6 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -28.76 -60.59 0.13 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.515 -1.22 . . . . 1.0 113.862 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.0 p -88.98 22.56 2.68 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 121.259 3.8 . . . . 1.0 121.259 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.615 ' HB3' ' CG ' ' A' ' 18' ' ' LYS . . . -140.88 3.77 1.85 Allowed 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 117.245 -1.782 . . . . 1.0 106.901 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -49.98 -55.74 13.44 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 116.169 -2.213 . . . . 1.0 108.423 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.414 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 10.8 p90 -60.78 -13.78 17.34 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 114.284 -1.325 . . . . 1.0 112.694 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -86.71 -42.41 13.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 120.459 -0.496 . . . . 1.0 110.467 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.736 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -89.54 -58.33 2.56 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 103.97 -2.604 . . . . 1.0 103.97 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 178.57 -62.35 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.524 -1.658 . . . . 1.0 106.524 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -150.95 -65.01 0.19 Allowed 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 110.493 -3.048 . . . . 1.0 114.671 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.793 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -101.22 143.52 31.19 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 113.233 -1.803 . . . . 1.0 114.224 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.749 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -167.76 -86.89 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 119.527 3.158 . . . . 1.0 119.527 179.593 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -30.43 0.11 Allowed 'General case' 0 N--CA 1.525 3.32 0 N-CA-C 119.343 3.09 . . . . 1.0 119.343 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.544 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 88.4 m -112.59 -7.74 13.86 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.628 1.571 . . . . 1.0 109.758 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.872 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.3 m . . . . . 0 C--N 1.295 -1.788 0 CA-C-N 111.858 -2.428 . . . . 1.0 113.641 -179.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.262 0 N-CA-C 100.943 -3.725 . . . . 1.0 100.943 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.59 175.98 7.85 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 113.329 -1.76 . . . . 1.0 110.248 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.602 ' CB ' HD11 ' A' ' 7' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.576 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -111.18 -69.85 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 C-N-CA 120.959 -0.296 . . . . 1.0 111.621 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.576 ' H ' HD13 ' A' ' 4' ' ' ILE . 35.8 t70 -146.29 -126.03 0.07 Allowed 'General case' 0 C--N 1.299 -1.613 0 O-C-N 124.056 0.848 . . . . 1.0 109.594 -179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.49 ' H ' ' CG ' ' A' ' 5' ' ' ASP . 5.2 t -33.41 -24.84 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 C-N-CA 127.739 2.415 . . . . 1.0 116.013 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.889 HD13 ' SG ' ' A' ' 12' ' ' CYS . 0.8 OUTLIER -59.44 163.2 6.91 Favored Pre-proline 0 C--N 1.3 -1.568 0 CA-C-N 115.273 -0.876 . . . . 1.0 113.21 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.542 ' O ' ' N ' ' A' ' 10' ' ' SER . 72.6 Cg_exo -40.34 66.54 0.0 OUTLIER 'Trans proline' 0 N--CA 1.504 2.136 1 C-N-CA 127.078 5.185 . . . . 1.0 115.493 165.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.42 ' N ' ' O ' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -18.8 66.02 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 117.263 2.32 . . . . 1.0 117.263 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.542 ' N ' ' O ' ' A' ' 8' ' ' PRO . 97.4 p -144.14 -101.67 0.11 Allowed 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 114.082 -1.417 . . . . 1.0 110.951 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -132.4 24.52 4.46 Favored 'General case' 0 C--N 1.306 -1.286 0 N-CA-C 115.48 1.659 . . . . 1.0 115.48 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.889 ' SG ' HD13 ' A' ' 7' ' ' ILE . 1.1 p -102.23 138.0 39.75 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 106.951 -1.5 . . . . 1.0 106.951 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.631 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -153.61 151.31 29.58 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 117.992 -1.004 . . . . 1.0 110.377 -179.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.808 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -66.46 -11.05 50.13 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.522 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -81.92 2.01 32.58 Favored 'General case' 0 C--N 1.309 -1.175 0 N-CA-C 107.733 -1.21 . . . . 1.0 107.733 179.487 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.631 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.5 -66.97 0.18 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 124.227 0.955 . . . . 1.0 111.986 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.575 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.8 t -29.57 -44.56 0.04 OUTLIER 'General case' 0 N--CA 1.52 3.032 0 CA-C-O 123.229 1.49 . . . . 1.0 112.951 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -172.21 71.22 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 110.709 -2.951 . . . . 1.0 113.437 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.522 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 85.5 m-70 -29.56 -84.44 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 114.841 1.423 . . . . 1.0 114.841 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.83 78.26 2.75 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 123.727 1.727 . . . . 1.0 110.778 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.658 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.72 -12.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 112.367 -2.197 . . . . 1.0 110.035 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.808 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -54.34 -20.15 6.75 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 118.066 -1.454 . . . . 1.0 113.512 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.532 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 29.6 p90 -96.97 5.06 51.16 Favored 'General case' 0 N--CA 1.499 1.977 0 CA-C-O 122.105 0.955 . . . . 1.0 109.659 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.532 ' HD3' ' CE1' ' A' ' 23' ' ' TYR . 11.6 mtp85 -109.49 -48.02 3.3 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.946 -1.479 . . . . 1.0 108.14 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.668 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -90.78 -79.06 0.37 Allowed 'General case' 0 N--CA 1.481 1.123 1 N-CA-C 98.769 -4.53 . . . . 1.0 98.769 178.989 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.7 m 178.71 -43.81 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 106.824 -1.547 . . . . 1.0 106.824 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 46.7 m-85 -159.77 -64.5 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 113.529 -1.668 . . . . 1.0 113.959 -179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -111.53 155.84 22.65 Favored 'General case' 0 C--N 1.299 -1.595 0 CA-C-N 112.433 -2.167 . . . . 1.0 111.408 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 2.7 ttp180 -176.55 -89.62 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 116.874 2.176 . . . . 1.0 116.874 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -39.9 -42.53 1.35 Allowed 'General case' 0 N--CA 1.521 3.107 0 N-CA-C 116.622 2.082 . . . . 1.0 116.622 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.575 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 6.9 m -105.21 1.33 28.1 Favored 'General case' 0 N--CA 1.513 2.689 0 CA-C-O 124.449 2.071 . . . . 1.0 111.843 -179.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.881 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 5.0 m -113.25 -11.87 13.16 Favored 'General case' 0 C--N 1.282 -2.363 0 CA-C-N 109.704 -3.407 . . . . 1.0 115.238 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 41.53 21.44 0.06 OUTLIER Glycine 0 N--CA 1.502 3.046 0 CA-C-N 118.418 0.554 . . . . 1.0 113.251 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.2 t -99.0 -37.81 9.23 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 117.736 2.495 . . . . 1.0 117.736 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.536 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 CA-C-O 117.943 -1.027 . . . . 1.0 110.033 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.0 t -121.31 -165.49 1.24 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 118.491 -1.284 . . . . 1.0 108.808 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.603 ' HG1' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.912 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -111.39 -120.8 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 104.579 -2.378 . . . . 1.0 104.579 179.392 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.48 ' N ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -100.58 37.1 1.76 Allowed 'General case' 0 C--N 1.298 -1.644 0 CA-C-N 115.13 -0.941 . . . . 1.0 110.935 -179.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.72 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.8 OUTLIER -94.15 154.95 17.32 Favored 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 121.458 0.647 . . . . 1.0 110.662 179.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.54 HD13 ' H ' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -59.87 -52.68 71.95 Favored Pre-proline 0 N--CA 1.501 2.079 0 CA-C-N 115.13 -0.941 . . . . 1.0 112.826 -179.502 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.656 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 10.2 Cg_endo -57.48 83.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.487 1.134 0 C-N-CA 122.786 2.324 . . . . 1.0 107.941 165.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.603 ' HA ' ' HG1' ' A' ' 3' ' ' ABA . 0.2 OUTLIER -77.62 54.77 1.24 Allowed 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 112.934 -1.939 . . . . 1.0 110.336 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -121.39 -123.1 0.28 Allowed 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 112.083 -2.326 . . . . 1.0 106.486 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.6 78.45 1.79 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.729 -1.952 . . . . 1.0 105.729 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.833 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -135.82 129.13 31.98 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 102.41 -3.181 . . . . 1.0 102.41 179.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.546 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -148.92 153.27 37.76 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 113.394 -1.73 . . . . 1.0 109.252 -179.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.827 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.72 10.22 4.29 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 105.414 -2.069 . . . . 1.0 105.414 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.558 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -101.95 -0.54 33.66 Favored 'General case' 0 C--O 1.208 -1.123 0 N-CA-C 105.233 -2.136 . . . . 1.0 105.233 179.559 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.546 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -158.3 -52.03 0.07 Allowed 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 112.652 0.612 . . . . 1.0 112.652 178.674 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.597 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.0 t -29.86 -55.74 0.17 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 124.952 1.407 . . . . 1.0 110.687 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.487 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -168.61 77.87 0.13 Allowed 'General case' 0 N--CA 1.488 1.454 1 O-C-N 129.389 4.18 . . . . 1.0 109.892 -179.607 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.544 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -29.92 -87.84 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 116.971 2.212 . . . . 1.0 116.971 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.24 77.0 0.25 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 123.245 1.498 . . . . 1.0 112.445 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.696 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.8 -12.8 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 113.274 -1.785 . . . . 1.0 109.066 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.827 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.9 pttt -55.51 -19.69 10.54 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.163 -1.415 . . . . 1.0 111.725 179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -95.97 11.47 33.87 Favored 'General case' 0 N--CA 1.496 1.838 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.415 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.3 mtp85 -120.4 -47.32 2.35 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 113.78 -1.555 . . . . 1.0 109.054 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.696 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -91.5 -74.07 0.52 Allowed 'General case' 0 C--N 1.312 -1.026 1 N-CA-C 99.311 -4.329 . . . . 1.0 99.311 179.09 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.01 -50.85 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 CA-C-O 123.702 1.715 . . . . 1.0 107.777 179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.535 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 62.2 m-85 -161.08 -63.28 0.06 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.296 -3.138 . . . . 1.0 111.901 -178.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.768 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.9 m -109.82 137.2 47.95 Favored 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 113.578 -1.646 . . . . 1.0 114.0 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.533 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 10.1 ttp180 -166.91 -56.4 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.352 0 N-CA-C 116.879 2.177 . . . . 1.0 116.879 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.0 tttt -66.25 -79.22 0.05 OUTLIER 'General case' 0 N--CA 1.511 2.62 0 C-N-CA 117.323 -1.751 . . . . 1.0 108.285 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.597 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 59.5 m -59.21 -12.55 5.5 Favored 'General case' 0 N--CA 1.509 2.517 0 CA-C-O 122.428 1.109 . . . . 1.0 110.257 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.833 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 1.7 m -98.06 -14.85 20.28 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 117.73 2.492 . . . . 1.0 117.73 -179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 34.53 27.9 0.01 OUTLIER Glycine 0 N--CA 1.504 3.208 0 O-C-N 124.228 0.955 . . . . 1.0 113.53 -179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.509 HG23 ' N ' ' A' ' 35' ' ' ABA . 15.0 t -100.83 -75.04 0.59 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 117.393 2.368 . . . . 1.0 117.393 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.509 ' N ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 112.691 0.626 . . . . 1.0 112.691 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.75 172.35 12.09 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 106.026 -1.842 . . . . 1.0 106.026 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.751 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.938 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -113.3 -92.45 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 CA-C-O 117.83 -1.081 . . . . 1.0 112.266 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.938 ' H ' HD13 ' A' ' 4' ' ' ILE . 12.3 t70 -120.19 -105.58 0.38 Allowed 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 115.594 1.701 . . . . 1.0 115.594 -179.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.76 1.25 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 116.416 2.006 . . . . 1.0 116.416 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.751 HD11 ' HB2' ' A' ' 3' ' ' ABA . 0.0 OUTLIER -81.66 171.56 11.79 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 108.289 -1.004 . . . . 1.0 108.289 179.829 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.423 ' HD2' ' SG ' ' A' ' 12' ' ' CYS . 11.5 Cg_endo -56.75 119.31 6.46 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 N-CA-C 106.502 -2.153 . . . . 1.0 106.502 168.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -68.55 73.02 0.23 Allowed 'General case' 0 N--CA 1.498 1.936 0 CA-C-O 123.194 1.473 . . . . 1.0 108.911 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 16.0 m -147.79 -109.52 0.08 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.488 -1.233 . . . . 1.0 110.236 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.96 37.14 4.2 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 116.422 2.008 . . . . 1.0 116.422 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER -119.65 132.69 55.75 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 105.13 -2.174 . . . . 1.0 105.13 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.658 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -147.97 150.33 33.82 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-O 117.495 -1.241 . . . . 1.0 109.997 -179.597 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -65.82 -10.84 41.4 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 105.758 -1.942 . . . . 1.0 105.758 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.572 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -81.9 1.7 33.94 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.433 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.658 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -157.34 -60.28 0.09 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.328 1.018 . . . . 1.0 112.432 179.254 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.634 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.7 t -30.61 -45.21 0.06 Allowed 'General case' 0 N--CA 1.518 2.972 0 N-CA-C 114.212 1.19 . . . . 1.0 114.212 -179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.472 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -174.05 75.21 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.551 0 O-C-N 127.86 3.225 . . . . 1.0 113.772 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.459 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 73.8 m-70 -28.8 -94.21 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 118.601 2.815 . . . . 1.0 118.601 -179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.17 34.71 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.847 1.425 . . . . 1.0 114.847 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.597 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -139.12 0.93 1.98 Allowed 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 117.857 -1.068 . . . . 1.0 108.318 179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.724 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.6 pttp -50.08 -52.34 35.43 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 116.511 -2.075 . . . . 1.0 108.074 179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.434 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 25.3 p90 -62.83 -8.89 7.77 Favored 'General case' 0 N--CA 1.492 1.625 0 CA-C-N 114.338 -1.301 . . . . 1.0 112.305 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.9 mtp85 -97.39 -36.92 10.21 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 118.163 -0.922 . . . . 1.0 110.752 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.711 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -102.03 -58.1 1.94 Allowed 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 105.067 -2.197 . . . . 1.0 105.067 179.344 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 177.85 -67.56 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.623 0 CA-C-O 124.44 2.067 . . . . 1.0 106.115 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -157.09 -52.11 0.07 Allowed 'General case' 0 N--CA 1.489 1.491 0 CA-C-N 108.47 -3.968 . . . . 1.0 112.866 -179.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.778 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -117.93 151.01 38.27 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.383 -1.281 . . . . 1.0 109.143 -179.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.52 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 1.2 tmm_? -167.75 -88.54 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 117.796 2.517 . . . . 1.0 117.796 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.495 ' HE3' ' OG1' ' A' ' 31' ' ' THR . 0.0 OUTLIER -49.96 -22.85 1.7 Allowed 'General case' 0 N--CA 1.51 2.529 0 N-CA-C 117.631 2.456 . . . . 1.0 117.631 -179.316 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.634 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 5.3 m -114.51 -0.49 13.7 Favored 'General case' 0 N--CA 1.513 2.683 0 CA-C-O 124.574 2.13 . . . . 1.0 110.253 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 12' ' ' CYS 0.267 15.5 m -110.39 176.61 4.98 Favored 'General case' 0 C--N 1.285 -2.204 0 CA-C-N 108.87 -3.786 . . . . 1.0 108.956 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -133.16 34.13 2.49 Favored Glycine 0 N--CA 1.501 2.997 0 N-CA-C 106.393 -2.683 . . . . 1.0 106.393 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.27 -78.41 0.54 Allowed 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 117.287 2.329 . . . . 1.0 117.287 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.488 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 104.913 -2.254 . . . . 1.0 104.913 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.79 -150.53 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.489 0 O-C-N 124.964 1.415 . . . . 1.0 110.932 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.746 HD13 ' H ' ' A' ' 5' ' ' ASP 0.295 0.0 OUTLIER -114.65 -120.96 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 N-CA-C 102.113 -3.292 . . . . 1.0 102.113 -179.757 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.746 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.3 OUTLIER -139.0 65.39 1.45 Allowed 'General case' 0 C--N 1.298 -1.656 0 CA-C-O 123.292 1.52 . . . . 1.0 110.946 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.58 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.1 OUTLIER -100.8 -121.78 0.16 Allowed 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 102.933 -2.988 . . . . 1.0 102.933 179.555 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.405 ' HB ' ' HD3' ' A' ' 8' ' ' PRO . 3.2 mt -111.89 -64.26 0.03 OUTLIER Pre-proline 0 N--CA 1.495 1.815 0 N-CA-C 109.252 -0.647 . . . . 1.0 109.252 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.713 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 60.9 Cg_endo -74.27 95.36 0.92 Allowed 'Trans proline' 0 C--N 1.31 -1.449 0 N-CA-C 106.374 -2.202 . . . . 1.0 106.374 -176.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.467 ' NZ ' ' CG ' ' A' ' 5' ' ' ASP . 17.1 tttp -78.41 66.46 3.97 Favored 'General case' 0 N--CA 1.501 2.104 0 CA-C-O 123.148 1.452 . . . . 1.0 109.564 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 43.9 m -119.88 -107.87 0.36 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-N 111.415 -2.629 . . . . 1.0 103.943 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.34 78.48 1.58 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.674 -1.973 . . . . 1.0 105.674 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.837 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -145.02 137.09 25.81 Favored 'General case' 0 C--N 1.295 -1.787 0 N-CA-C 104.114 -2.55 . . . . 1.0 104.114 179.357 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.5 HG23 ' OE1' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -158.82 158.0 32.67 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 105.426 -2.064 . . . . 1.0 105.426 179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.777 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -75.76 -1.71 26.34 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 105.532 -2.025 . . . . 1.0 105.532 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.535 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -90.86 2.42 56.16 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 105.867 -1.901 . . . . 1.0 105.867 179.519 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.5 ' OE1' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -154.92 -60.81 0.12 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 112.313 0.486 . . . . 1.0 112.313 178.276 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 31' ' ' THR . 2.7 t -31.1 -53.29 0.2 Allowed 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 123.855 1.788 . . . . 1.0 110.33 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.49 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.4 OUTLIER -165.87 71.06 0.14 Allowed 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 111.347 -2.66 . . . . 1.0 113.547 -179.679 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.535 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.76 -79.46 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 113.983 1.105 . . . . 1.0 113.983 179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.46 71.6 1.82 Allowed 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 123.981 1.848 . . . . 1.0 113.226 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.791 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.48 -10.81 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 112.27 -2.241 . . . . 1.0 109.68 179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.777 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 23.3 pttt -55.91 -19.26 11.38 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 116.614 -2.034 . . . . 1.0 113.099 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -94.3 2.58 55.84 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-O 122.083 0.944 . . . . 1.0 110.245 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.431 HH21 ' HB3' ' A' ' 24' ' ' ARG . 3.4 mtp85 -109.46 -46.59 3.52 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 113.462 -1.699 . . . . 1.0 112.341 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.791 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -90.54 -72.19 0.58 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 101.455 -3.535 . . . . 1.0 101.455 179.625 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 30.7 m 179.58 -50.89 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.022 -1.473 . . . . 1.0 107.022 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.451 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 30.8 m-85 -162.61 -58.64 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 CA-C-N 113.241 -1.8 . . . . 1.0 111.302 -179.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.761 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.08 155.41 23.9 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-N 114.209 -1.359 . . . . 1.0 109.927 -179.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.566 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 9.5 ttp85 -177.83 -89.4 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 O-C-N 125.095 1.497 . . . . 1.0 113.539 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -35.65 -44.47 0.32 Allowed 'General case' 0 N--CA 1.523 3.183 0 N-CA-C 119.958 3.318 . . . . 1.0 119.958 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.503 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 24.8 m -101.26 -5.72 25.13 Favored 'General case' 0 N--CA 1.508 2.44 0 CA-C-O 123.454 1.597 . . . . 1.0 109.227 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.837 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 6.7 m -98.88 158.78 15.41 Favored 'General case' 0 C--N 1.287 -2.13 0 CA-C-N 110.652 -2.976 . . . . 1.0 115.193 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.06 41.74 2.13 Favored Glycine 0 N--CA 1.492 2.429 0 CA-C-N 111.745 -2.479 . . . . 1.0 110.547 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.407 ' OG1' ' HG3' ' A' ' 35' ' ' ABA . 0.1 OUTLIER -111.33 -79.63 0.58 Allowed 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 113.807 -1.197 . . . . 1.0 109.351 179.385 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.407 ' HG3' ' OG1' ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 . . . . . 0 N--CA 1.505 2.296 0 N-CA-C 101.474 -3.528 . . . . 1.0 101.474 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -137.61 179.52 6.37 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-N 113.099 -1.864 . . . . 1.0 107.539 -179.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.874 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -108.92 -89.38 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 106.19 -1.781 . . . . 1.0 106.19 179.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.874 ' H ' HD13 ' A' ' 4' ' ' ILE . 14.9 t70 -147.16 -87.08 0.09 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 124.813 1.32 . . . . 1.0 109.703 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.2 m -18.01 -103.08 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 119.883 3.29 . . . . 1.0 119.883 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.426 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 2.5 pt -128.58 48.28 3.45 Favored Pre-proline 0 N--CA 1.51 2.574 0 CA-C-N 121.602 2.001 . . . . 1.0 114.066 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' C ' ' H ' ' A' ' 10' ' ' SER . 69.7 Cg_endo -82.28 89.16 1.21 Allowed 'Trans proline' 0 C--N 1.306 -1.68 0 C-N-CA 122.749 2.299 . . . . 1.0 110.02 177.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -71.04 30.63 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.055 0 C-N-CA 119.066 -1.053 . . . . 1.0 113.252 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.43 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.6 OUTLIER 179.97 -110.54 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 C-N-CA 123.427 0.691 . . . . 1.0 109.411 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -131.1 57.53 1.75 Allowed 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.873 -0.517 . . . . 1.0 111.136 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -109.91 132.4 54.19 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 105.135 -2.172 . . . . 1.0 105.135 179.537 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.56 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -147.66 163.37 36.85 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.896 -1.52 . . . . 1.0 106.896 179.59 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.767 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.92 -1.62 40.14 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 106.111 -1.811 . . . . 1.0 106.111 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.528 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -90.51 1.18 56.95 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 104.609 -2.367 . . . . 1.0 104.609 179.432 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.56 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.59 -61.34 0.15 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 178.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.537 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.0 t -29.97 -52.21 0.14 Allowed 'General case' 0 N--CA 1.523 3.212 0 CA-C-O 123.947 1.832 . . . . 1.0 110.303 -179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.597 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -168.9 79.31 0.13 Allowed 'General case' 0 C--N 1.301 -1.533 0 CA-C-N 110.941 -2.845 . . . . 1.0 112.463 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.7 m-70 -29.93 -78.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.782 1.771 . . . . 1.0 115.782 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.17 40.42 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 118.625 2.824 . . . . 1.0 118.625 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -148.48 2.18 0.63 Allowed 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.349 -1.47 . . . . 1.0 108.388 179.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.767 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 22.2 pttm -59.32 -28.96 67.28 Favored 'General case' 0 C--N 1.302 -1.463 0 C-N-CA 116.881 -1.928 . . . . 1.0 108.35 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 24' ' ' ARG . 17.5 p90 -87.22 9.01 21.52 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 113.82 -1.536 . . . . 1.0 110.282 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.515 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 4.0 mtp85 -114.62 -49.69 2.81 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.453 -1.249 . . . . 1.0 110.884 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.733 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.77 -66.65 0.91 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 103.434 -2.802 . . . . 1.0 103.434 179.407 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.455 ' H ' HD22 ' A' ' 25' ' ' LEU . 27.7 m 179.75 -51.91 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 N-CA-C 105.431 -2.063 . . . . 1.0 105.431 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.476 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 39.0 m-85 -160.33 -66.12 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 112.783 -2.008 . . . . 1.0 109.33 -179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.807 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -103.11 156.96 17.32 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 111.764 -2.471 . . . . 1.0 111.987 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.54 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 1.3 ttm180 179.03 -88.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.89 0 N-CA-C 115.045 1.498 . . . . 1.0 115.045 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.29 -38.91 1.26 Allowed 'General case' 0 N--CA 1.516 2.856 0 N-CA-C 118.412 2.745 . . . . 1.0 118.412 -179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 32.1 m -104.41 -5.0 22.1 Favored 'General case' 0 N--CA 1.508 2.425 0 CA-C-O 122.693 1.235 . . . . 1.0 108.025 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.808 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 23.7 m -97.35 164.78 12.32 Favored 'General case' 0 C--N 1.286 -2.155 0 CA-C-N 112.411 -2.177 . . . . 1.0 116.279 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.34 41.24 2.28 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 108.136 -1.986 . . . . 1.0 108.136 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.505 HG23 ' N ' ' A' ' 35' ' ' ABA . 2.2 t -109.77 -81.74 0.57 Allowed 'General case' 0 N--CA 1.502 2.143 0 CA-C-N 113.817 -1.192 . . . . 1.0 112.719 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.505 ' N ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.53 ' HA ' ' NH2' ' A' ' 11' ' ' ARG . 1.3 m 179.61 -157.49 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 104.509 -2.404 . . . . 1.0 104.509 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.673 ' HG3' ' H ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.82 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -109.41 -123.41 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 N-CA-C 107.576 -1.268 . . . . 1.0 107.576 179.635 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.494 ' N ' HG12 ' A' ' 4' ' ' ILE . 29.0 p-10 -105.61 39.24 1.8 Allowed 'General case' 0 C--N 1.299 -1.603 0 O-C-N 124.611 1.194 . . . . 1.0 111.919 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.567 HG21 ' SG ' ' A' ' 28' ' ' CYS . 1.7 p -95.77 -153.42 0.4 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.503 -0.748 . . . . 1.0 111.109 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.464 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -101.92 -48.05 0.18 Allowed Pre-proline 0 N--CA 1.505 2.324 0 CA-C-O 119.167 -0.444 . . . . 1.0 111.928 -179.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' O ' ' HG1' ' A' ' 3' ' ' ABA . 42.5 Cg_endo -74.61 130.24 13.51 Favored 'Trans proline' 0 C--N 1.313 -1.291 0 N-CA-C 107.465 -1.783 . . . . 1.0 107.465 165.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.7 pttm -100.67 47.42 0.92 Allowed 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.392 -2.185 . . . . 1.0 107.162 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 m -104.47 -111.6 0.25 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.112 -1.403 . . . . 1.0 108.649 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' NH2' ' HA ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -146.34 69.8 1.21 Allowed 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 105.963 -1.865 . . . . 1.0 105.963 179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.811 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -126.86 121.91 33.17 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 105.211 -2.144 . . . . 1.0 105.211 -179.526 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.55 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -148.3 163.59 36.6 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 105.338 -2.097 . . . . 1.0 105.338 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.902 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.24 1.96 19.86 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 116.988 -1.885 . . . . 1.0 106.088 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -98.72 1.94 46.57 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 105.938 -1.875 . . . . 1.0 105.938 179.528 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.525 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -150.74 -62.85 0.19 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 123.516 0.51 . . . . 1.0 109.815 178.12 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.662 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.6 OUTLIER -37.79 -51.3 1.27 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 125.075 1.484 . . . . 1.0 111.301 -179.748 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.44 ' CD ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -163.88 68.57 0.18 Allowed 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 116.012 -2.275 . . . . 1.0 114.122 -179.297 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.556 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 90.4 m-70 -28.38 -85.16 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 125.034 1.459 . . . . 1.0 114.797 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.465 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.39 46.65 0.27 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 114.375 1.25 . . . . 1.0 114.375 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.622 ' HA ' ' NH1' ' A' ' 24' ' ' ARG . . . -158.48 -0.32 0.09 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.792 -1.549 . . . . 1.0 107.943 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.902 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.1 pttt -56.0 -21.9 23.88 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 116.7 -2.0 . . . . 1.0 111.628 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.58 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 6.6 p90 -94.68 4.0 54.37 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 124.281 0.988 . . . . 1.0 110.662 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.667 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.5 tpp180 -100.76 -49.81 4.05 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.672 -0.862 . . . . 1.0 108.672 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.772 HD12 ' HE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -86.33 -68.87 0.71 Allowed 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 106.654 -1.61 . . . . 1.0 106.654 179.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 21.3 m 178.98 -49.83 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 105.19 -2.152 . . . . 1.0 105.19 179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.508 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 16.2 m-85 -167.27 -50.47 0.02 OUTLIER 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 109.513 -3.494 . . . . 1.0 109.989 -179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.81 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -116.95 144.31 44.7 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 117.212 2.301 . . . . 1.0 117.212 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.772 ' HE ' HD12 ' A' ' 25' ' ' LEU . 2.3 ttm180 -170.11 -84.99 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.351 0 N-CA-C 118.271 2.693 . . . . 1.0 118.271 179.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.3 mmtm -43.94 -23.83 0.11 Allowed 'General case' 0 N--CA 1.527 3.378 0 N-CA-C 119.425 3.12 . . . . 1.0 119.425 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.662 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 97.0 m -116.91 -8.66 11.27 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 123.795 1.759 . . . . 1.0 108.382 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.811 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.4 m -100.42 166.07 11.13 Favored 'General case' 0 C--N 1.288 -2.066 0 CA-C-N 112.104 -2.316 . . . . 1.0 114.621 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -113.13 40.63 2.46 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 105.456 -3.058 . . . . 1.0 105.456 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 11.1 p -95.37 -80.52 0.42 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.83 0.824 . . . . 1.0 111.643 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.205 1 N-CA-C 99.042 -4.429 . . . . 1.0 99.042 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.35 -169.6 2.36 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 118.56 -1.256 . . . . 1.0 110.749 -178.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.52 ' HG1' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.866 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -105.88 -119.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 105.094 -2.187 . . . . 1.0 105.094 179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.466 ' N ' HG12 ' A' ' 4' ' ' ILE . 3.6 m-20 -91.75 27.82 1.96 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 124.098 0.874 . . . . 1.0 111.604 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.6 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -81.88 156.98 24.54 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 100.452 -3.907 . . . . 1.0 100.452 179.417 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -43.24 96.04 Favored Pre-proline 0 N--CA 1.513 2.681 0 N-CA-C 117.446 2.387 . . . . 1.0 117.446 -178.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.615 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 89.7 Cg_endo -75.29 108.87 2.81 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 N-CA-C 106.847 -2.02 . . . . 1.0 106.847 -175.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.52 ' HA ' ' HG1' ' A' ' 3' ' ' ABA . 14.6 tttm -78.17 75.61 4.69 Favored 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 117.606 -1.638 . . . . 1.0 110.972 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -144.76 -102.56 0.11 Allowed 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 115.911 -0.586 . . . . 1.0 109.963 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.1 64.54 1.38 Allowed 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.52 1.152 . . . . 1.0 110.813 179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.777 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -131.52 122.02 25.44 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 113.27 -1.786 . . . . 1.0 107.662 -179.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.579 ' HB ' HD12 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -146.93 155.34 42.21 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 103.12 -2.918 . . . . 1.0 103.12 179.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.665 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.7 11.11 3.37 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 116.518 -2.073 . . . . 1.0 105.506 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.525 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -100.76 1.78 40.65 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.786 -1.931 . . . . 1.0 105.786 179.572 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.469 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -155.28 -59.85 0.11 Allowed 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.938 -0.705 . . . . 1.0 110.714 178.568 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.777 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -34.86 -57.82 0.53 Allowed 'General case' 0 N--CA 1.485 1.282 0 O-C-N 125.21 1.569 . . . . 1.0 110.453 -179.571 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.545 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -162.5 72.06 0.33 Allowed 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 112.396 -2.184 . . . . 1.0 113.022 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.502 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.51 -75.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 115.649 1.722 . . . . 1.0 115.649 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.35 44.16 0.25 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 115.342 1.608 . . . . 1.0 115.342 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.598 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . -146.32 4.06 0.91 Allowed 'General case' 0 C--N 1.299 -1.627 0 C-N-CA 118.62 -1.232 . . . . 1.0 109.242 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 6.7 pttm -62.81 -21.81 66.18 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 115.441 -2.504 . . . . 1.0 106.45 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -97.7 10.81 39.06 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 114.156 -1.384 . . . . 1.0 110.116 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.598 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -105.49 -51.28 3.04 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.104 -1.073 . . . . 1.0 108.104 179.189 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -98.04 -99.8 0.21 Allowed 'General case' 0 C--N 1.306 -1.288 1 N-CA-C 97.792 -4.892 . . . . 1.0 97.792 179.31 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.467 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 71.1 m -139.82 -47.54 0.45 Allowed 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 106.433 -1.692 . . . . 1.0 106.433 179.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -152.81 -61.86 0.15 Allowed 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 113.018 -1.901 . . . . 1.0 109.152 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.6 ' SG ' HG21 ' A' ' 6' ' ' THR . 1.3 m -112.07 147.51 35.87 Favored 'General case' 0 N--CA 1.502 2.133 0 N-CA-C 117.444 2.387 . . . . 1.0 117.444 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.836 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.0 OUTLIER -151.77 -86.85 0.07 Allowed 'General case' 0 CA--C 1.571 1.778 0 CA-C-N 113.183 -1.826 . . . . 1.0 112.099 178.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 7.6 tptp -31.0 -53.42 0.2 Allowed 'General case' 0 N--CA 1.513 2.709 1 N-CA-C 124.131 4.863 . . . . 1.0 124.131 -179.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.618 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 3.5 m -113.26 4.98 16.72 Favored 'General case' 0 N--CA 1.533 3.699 0 CA-C-O 125.505 2.574 . . . . 1.0 112.405 -179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.836 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -90.18 164.07 14.57 Favored 'General case' 0 C--N 1.278 -2.51 1 CA-C-N 107.977 -4.192 . . . . 1.0 112.703 -179.877 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' H ' ' HG3' ' A' ' 8' ' ' PRO . . . -122.68 35.55 3.4 Favored Glycine 0 N--CA 1.494 2.557 0 N-CA-C 108.399 -1.88 . . . . 1.0 108.399 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.96 -91.26 0.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 103.802 -2.666 . . . . 1.0 103.802 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.83 0 N-CA-C 107.655 -1.239 . . . . 1.0 107.655 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 m -151.82 -151.22 0.38 Allowed 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.92 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -115.97 -96.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 106.681 -1.6 . . . . 1.0 106.681 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.92 ' H ' HD13 ' A' ' 4' ' ' ILE . 3.1 t70 -132.74 -92.84 0.36 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.452 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 26.1 p -18.96 -96.9 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.966 3.321 . . . . 1.0 119.966 -179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.467 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.3 pt -127.4 41.54 0.72 Allowed Pre-proline 0 N--CA 1.508 2.431 0 N-CA-C 116.712 2.115 . . . . 1.0 116.712 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.467 ' CD ' ' N ' ' A' ' 7' ' ' ILE . 88.0 Cg_endo -78.29 104.34 1.82 Allowed 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 124.48 3.453 . . . . 1.0 106.933 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -90.31 8.73 31.89 Favored 'General case' 0 N--CA 1.503 2.193 0 CA-C-O 123.166 1.46 . . . . 1.0 113.023 -179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.6 m -153.08 -110.42 0.04 OUTLIER 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 112.487 -2.142 . . . . 1.0 107.662 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.49 ' NH1' HG21 ' A' ' 31' ' ' THR . 0.0 OUTLIER -134.97 77.25 1.67 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 104.997 -2.223 . . . . 1.0 104.997 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.749 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -121.88 130.08 53.08 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 104.12 -2.548 . . . . 1.0 104.12 179.652 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.524 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -150.56 160.29 43.9 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.679 -0.859 . . . . 1.0 108.679 179.822 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.674 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.96 5.8 13.0 Favored 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 106.886 -1.524 . . . . 1.0 106.886 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.524 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -101.77 2.19 38.14 Favored 'General case' 0 C--N 1.308 -1.216 0 N-CA-C 105.144 -2.169 . . . . 1.0 105.144 179.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.466 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -157.79 -52.87 0.07 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 114.739 1.385 . . . . 1.0 114.739 178.353 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.6 ' SG ' ' N ' ' A' ' 31' ' ' THR . 4.4 t -29.3 -49.69 0.09 Allowed 'General case' 0 N--CA 1.512 2.635 0 O-C-N 124.833 1.333 . . . . 1.0 111.442 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.981 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.0 tppt? -178.33 82.59 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 110.781 -2.918 . . . . 1.0 108.521 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.509 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.3 m-70 -32.0 -84.8 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 115.992 1.849 . . . . 1.0 115.992 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.4 OUTLIER -61.95 30.11 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 118.142 2.645 . . . . 1.0 118.142 -179.6 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.981 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -146.89 4.24 0.84 Allowed 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 105.948 -1.871 . . . . 1.0 105.948 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.674 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 20.0 pttp -56.35 -30.79 63.08 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 117.023 -1.871 . . . . 1.0 107.079 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.574 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 25.5 p90 -85.69 6.39 27.86 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 115.588 -0.733 . . . . 1.0 112.573 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.736 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.3 tpp180 -103.1 -47.61 4.29 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 106.756 -1.572 . . . . 1.0 106.756 178.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.736 HD13 ' HB3' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -90.6 -71.79 0.61 Allowed 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 101.527 -3.508 . . . . 1.0 101.527 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.3 m 178.63 -47.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 106.192 -1.781 . . . . 1.0 106.192 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' HA ' ' HB2' ' A' ' 14' ' ' ALA . 61.1 m-85 -158.94 -65.66 0.08 Allowed 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 111.969 -2.378 . . . . 1.0 109.201 -179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.797 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.5 m -111.24 143.22 42.36 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 110.199 -3.182 . . . . 1.0 112.943 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.628 ' HG3' ' C ' ' A' ' 35' ' ' ABA . 0.8 OUTLIER 179.71 -34.71 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 117.173 2.286 . . . . 1.0 117.173 179.207 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.456 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 1.4 tmtp? -83.96 -53.86 5.27 Favored 'General case' 0 N--CA 1.514 2.75 0 CA-C-N 122.245 2.293 . . . . 1.0 109.519 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.6 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 90.2 m -84.41 -4.34 58.85 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 105.004 -2.221 . . . . 1.0 105.004 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.797 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.5 m -98.16 -67.03 0.87 Allowed 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 112.127 -2.306 . . . . 1.0 115.368 -179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 90.57 9.93 64.07 Favored Glycine 0 N--CA 1.504 3.193 0 N-CA-C 107.921 -2.072 . . . . 1.0 107.921 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.5 p -70.6 -84.39 0.03 OUTLIER 'General case' 0 C--N 1.306 -1.325 0 CA-C-N 113.196 -1.502 . . . . 1.0 113.085 -179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.628 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.42 ' C ' ' HG ' ' A' ' 2' ' ' SER . 25.8 mtp180 . . . . . 0 N--CA 1.494 1.758 0 N-CA-C 101.469 -3.53 . . . . 1.0 101.469 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.42 ' HG ' ' C ' ' A' ' 1' ' ' ARG . 1.1 m -161.14 114.39 1.96 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.609 HD13 ' N ' ' A' ' 5' ' ' ASP . 0.1 OUTLIER -113.46 -48.85 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.222 -1.029 . . . . 1.0 108.222 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.609 ' N ' HD13 ' A' ' 4' ' ' ILE . 4.6 t70 -120.24 -89.6 0.6 Allowed 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 113.714 -1.585 . . . . 1.0 107.863 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.451 HG21 ' HB2' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -46.86 177.58 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 123.787 1.756 . . . . 1.0 115.554 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 6.0 pt -121.07 77.76 32.26 Favored Pre-proline 0 N--CA 1.501 2.083 0 CA-C-N 113.1 -1.864 . . . . 1.0 113.603 -179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.621 ' HG3' ' H ' ' A' ' 12' ' ' CYS . 11.5 Cg_endo -86.79 174.92 5.39 Favored 'Trans proline' 0 C--N 1.307 -1.632 1 C-N-CA 125.781 4.321 . . . . 1.0 108.948 168.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.1 ttmt -88.08 25.2 1.64 Allowed 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.122 -1.031 . . . . 1.0 111.43 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.3 m -174.76 -100.27 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.518 0 N-CA-C 117.689 2.477 . . . . 1.0 117.689 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.07 62.09 1.43 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.43 1.27 . . . . 1.0 114.43 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -96.87 122.35 39.73 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 116.976 -1.89 . . . . 1.0 106.925 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.525 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -135.08 161.2 35.98 Favored 'General case' 0 C--N 1.289 -2.023 0 N-CA-C 103.478 -2.786 . . . . 1.0 103.478 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.658 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.96 0.26 21.73 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 104.872 -2.27 . . . . 1.0 104.872 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.59 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -94.52 4.0 54.41 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 106.924 -1.509 . . . . 1.0 106.924 179.726 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.525 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.14 -60.05 0.16 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.084 -0.962 . . . . 1.0 112.589 178.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.428 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 3.8 t -30.92 -47.49 0.1 Allowed 'General case' 0 N--CA 1.516 2.862 0 N-CA-C 114.083 1.142 . . . . 1.0 114.083 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.579 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 16.7 tppt? -173.89 74.34 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 109.861 -3.336 . . . . 1.0 112.263 -179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.59 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.6 m-70 -29.45 -80.55 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 116.734 2.124 . . . . 1.0 116.734 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.35 41.29 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.759 2.503 . . . . 1.0 117.759 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -146.92 0.87 0.75 Allowed 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 107.993 -1.114 . . . . 1.0 107.993 179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.658 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 36.5 pttt -58.16 -28.55 64.84 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 116.184 -2.206 . . . . 1.0 109.585 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 p90 -84.57 2.98 38.83 Favored 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.902 -1.044 . . . . 1.0 110.189 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -110.27 -47.56 3.28 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-N 113.878 -1.51 . . . . 1.0 112.519 179.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.879 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -94.9 -65.49 0.98 Allowed 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 103.552 -2.759 . . . . 1.0 103.552 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.45 ' H ' HD22 ' A' ' 25' ' ' LEU . 0.4 OUTLIER 178.73 -55.52 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 105.171 -2.159 . . . . 1.0 105.171 179.428 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.439 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 33.8 m-85 -157.18 -63.22 0.09 Allowed 'General case' 0 C--N 1.311 -1.105 0 CA-C-N 111.028 -2.806 . . . . 1.0 109.395 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.805 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -102.59 162.12 13.18 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 112.194 -2.276 . . . . 1.0 112.044 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.698 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 8.2 ttp85 177.59 -92.51 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 125.311 1.444 . . . . 1.0 111.897 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -31.92 -50.85 0.22 Allowed 'General case' 0 N--CA 1.51 2.572 0 N-CA-C 117.945 2.572 . . . . 1.0 117.945 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.428 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 7.5 m -97.56 -2.32 41.99 Favored 'General case' 0 N--CA 1.514 2.754 0 CA-C-N 113.842 -1.526 . . . . 1.0 112.169 -179.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.895 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 30.1 m -100.6 -53.29 3.12 Favored 'General case' 0 C--N 1.28 -2.418 0 CA-C-N 110.8 -2.909 . . . . 1.0 115.833 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 91.51 -7.62 79.76 Favored Glycine 0 N--CA 1.498 2.789 0 C-N-CA 119.946 -1.121 . . . . 1.0 111.092 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -65.03 -45.35 85.83 Favored 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 105.741 -1.948 . . . . 1.0 105.741 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.456 ' C ' ' CG ' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.431 ' N ' ' OE1' ' A' ' 16' ' ' GLN . 0.6 OUTLIER . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 108.158 -1.053 . . . . 1.0 108.158 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m -105.34 -154.54 0.51 Allowed 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 103.584 -2.747 . . . . 1.0 103.584 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.413 ' HB3' ' O ' ' A' ' 8' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.905 HD13 ' N ' ' A' ' 5' ' ' ASP 0.317 0.0 OUTLIER -119.88 -86.8 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.101 0 CA-C-N 118.632 0.651 . . . . 1.0 112.172 -179.537 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.905 ' N ' HD13 ' A' ' 4' ' ' ILE . 10.9 t70 -118.05 -98.19 0.45 Allowed 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 124.072 0.949 . . . . 1.0 113.459 -179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' A' ' 7' ' ' ILE . 0.4 OUTLIER -18.4 -102.91 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.235 0 N-CA-C 116.113 1.894 . . . . 1.0 116.113 -179.354 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.525 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pp -145.1 26.19 0.05 OUTLIER Pre-proline 0 N--CA 1.504 2.267 0 CA-C-N 121.366 1.893 . . . . 1.0 115.553 179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.765 ' CB ' ' SG ' ' A' ' 12' ' ' CYS . 19.2 Cg_endo -75.47 109.19 2.86 Favored 'Trans proline' 0 C--N 1.312 -1.342 0 CA-C-N 120.391 1.176 . . . . 1.0 110.774 -168.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tttm -81.68 51.79 1.77 Allowed 'General case' 0 C--N 1.294 -1.82 0 CA-C-N 115.233 -0.894 . . . . 1.0 109.341 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.5 t -156.03 -138.23 0.07 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.136 -0.938 . . . . 1.0 111.516 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.405 ' HB3' HH11 ' A' ' 11' ' ' ARG . 0.0 OUTLIER -125.06 39.96 3.85 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.734 -1.121 . . . . 1.0 108.428 -179.764 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.765 ' SG ' ' CB ' ' A' ' 8' ' ' PRO . 3.3 p -96.75 139.58 32.59 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 103.765 -2.68 . . . . 1.0 103.765 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.542 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.2 OUTLIER -151.13 159.67 44.32 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 179.663 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.771 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.47 1.85 15.36 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 105.265 -2.124 . . . . 1.0 105.265 179.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.4 OUTLIER -96.63 1.67 51.41 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 105.103 -2.184 . . . . 1.0 105.103 179.337 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.542 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -61.1 0.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.078 0.77 . . . . 1.0 113.078 178.544 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.7 t -29.4 -54.39 0.14 Allowed 'General case' 0 N--CA 1.505 2.298 0 CA-C-O 124.324 2.012 . . . . 1.0 111.583 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.454 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -167.21 75.09 0.15 Allowed 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 110.484 -3.053 . . . . 1.0 111.093 -179.128 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.546 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.6 m-70 -29.19 -79.66 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.124 1.898 . . . . 1.0 116.124 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.21 36.7 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 N-CA-C 119.221 3.045 . . . . 1.0 119.221 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -144.93 1.15 0.98 Allowed 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 118.588 -1.245 . . . . 1.0 108.118 179.276 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.771 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 15.2 pttp -58.36 -32.78 68.87 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 116.837 -1.945 . . . . 1.0 110.76 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 p90 -80.17 0.52 31.96 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 113.755 -1.566 . . . . 1.0 109.824 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mtp85 -111.74 -46.37 3.25 Favored 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 114.903 1.446 . . . . 1.0 114.903 179.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.863 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -89.77 -67.74 0.82 Allowed 'General case' 0 N--CA 1.483 1.196 1 N-CA-C 99.789 -4.152 . . . . 1.0 99.789 179.597 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.6 m 178.38 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 106.563 -1.643 . . . . 1.0 106.563 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.519 ' HB3' HD12 ' A' ' 4' ' ' ILE . 45.5 m-85 -161.0 -62.37 0.06 Allowed 'General case' 0 N--CA 1.488 1.461 0 CA-C-N 113.317 -1.765 . . . . 1.0 111.16 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.798 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.53 136.19 52.34 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 111.924 -2.398 . . . . 1.0 110.647 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.524 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -164.75 -50.08 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 N-CA-C 116.015 1.857 . . . . 1.0 116.015 -179.595 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 32' ' ' CYS . 0.3 OUTLIER -66.1 -83.54 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.932 -1.107 . . . . 1.0 108.058 -179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.571 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 14.8 m -59.25 -9.43 2.19 Favored 'General case' 0 N--CA 1.506 2.362 0 CA-C-O 122.964 1.364 . . . . 1.0 110.571 179.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.798 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m -94.04 -29.53 15.16 Favored 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 112.078 -2.328 . . . . 1.0 116.318 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 49.88 22.76 4.68 Favored Glycine 0 N--CA 1.496 2.648 0 O-C-N 124.354 1.034 . . . . 1.0 111.275 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.442 ' OG1' ' HA ' ' A' ' 29' ' ' ARG . 3.8 p -77.01 -73.79 0.28 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 116.243 1.942 . . . . 1.0 116.243 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.502 ' C ' ' HD3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 20.8 mtp180 . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 108.071 -1.085 . . . . 1.0 108.071 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.414 ' OG ' ' N ' ' A' ' 3' ' ' ABA . 26.3 t 179.87 -172.36 0.19 Allowed 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 104.762 -2.31 . . . . 1.0 104.762 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.414 ' N ' ' OG ' ' A' ' 2' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.745 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -118.72 -86.18 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-O 118.2 -0.905 . . . . 1.0 112.595 179.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.745 ' H ' HD13 ' A' ' 4' ' ' ILE . 21.0 t70 -118.28 -100.59 0.44 Allowed 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 115.912 1.819 . . . . 1.0 115.912 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -14.11 62.66 Favored 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 115.601 1.704 . . . . 1.0 115.601 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.698 ' HB ' ' SG ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -59.62 164.64 5.21 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 121.454 0.645 . . . . 1.0 112.17 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.578 ' O ' ' N ' ' A' ' 10' ' ' SER . 10.1 Cg_endo -56.31 80.27 0.04 OUTLIER 'Trans proline' 0 C--N 1.313 -1.333 0 C-N-CA 124.262 3.308 . . . . 1.0 111.286 169.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -30.45 67.14 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.449 0 N-CA-C 116.08 1.882 . . . . 1.0 116.08 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.578 ' N ' ' O ' ' A' ' 8' ' ' PRO . 48.2 m -147.21 -88.74 0.09 Allowed 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.032 1.123 . . . . 1.0 114.032 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -135.2 40.81 2.85 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 115.274 1.583 . . . . 1.0 115.274 -179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.782 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.6 OUTLIER -129.32 137.33 50.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 102.975 -2.972 . . . . 1.0 102.975 179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.59 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -159.64 138.45 10.8 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-O 116.058 -1.925 . . . . 1.0 109.109 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.816 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -56.39 -12.32 1.62 Allowed 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 117.907 -1.517 . . . . 1.0 108.193 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.509 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -83.15 4.43 26.59 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.24 -0.913 . . . . 1.0 111.129 179.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.59 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.58 -61.0 0.1 Allowed 'General case' 0 N--CA 1.493 1.714 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.597 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.799 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 0.1 OUTLIER -36.29 -46.14 0.51 Allowed 'General case' 0 N--CA 1.491 1.624 0 CA-C-N 113.972 -1.467 . . . . 1.0 113.832 -179.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -170.3 70.47 0.06 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.536 -2.575 . . . . 1.0 113.083 -179.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.439 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 81.8 m-70 -28.61 -92.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 117.508 2.41 . . . . 1.0 117.508 179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.464 ' O ' ' NH1' ' A' ' 24' ' ' ARG . 0.0 OUTLIER -74.81 56.92 0.75 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 115.289 -0.869 . . . . 1.0 113.266 -179.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.474 ' O ' HD22 ' A' ' 25' ' ' LEU . . . -156.36 -9.52 0.1 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 113.973 -1.467 . . . . 1.0 108.591 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.816 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.3 pttt -54.5 -22.46 12.98 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 118.321 -1.352 . . . . 1.0 111.131 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.513 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 27.7 p90 -93.94 8.01 42.92 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.882 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.612 ' HB3' HD13 ' A' ' 25' ' ' LEU . 2.1 tpp180 -108.4 -48.37 3.35 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 106.233 -1.765 . . . . 1.0 106.233 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.679 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -93.19 -77.81 0.44 Allowed 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 101.825 -3.398 . . . . 1.0 101.825 179.368 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 0.9 OUTLIER 178.99 -44.72 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.9 -1.519 . . . . 1.0 106.9 179.581 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.445 ' O ' ' HB2' ' A' ' 14' ' ' ALA . 50.6 m-85 -163.43 -59.45 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 111.62 -2.536 . . . . 1.0 112.04 -179.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.618 ' O ' HG23 ' A' ' 34' ' ' THR . 1.2 m -127.19 124.18 38.39 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 119.886 3.291 . . . . 1.0 119.886 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.888 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 4.4 ttm180 -139.33 -87.41 0.22 Allowed 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -29.52 -69.81 0.06 Allowed 'General case' 0 N--CA 1.528 3.432 0 N-CA-C 119.386 3.106 . . . . 1.0 119.386 -179.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.799 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 25.3 m -86.65 0.54 54.34 Favored 'General case' 0 N--CA 1.524 3.261 0 CA-C-O 125.175 2.417 . . . . 1.0 109.867 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.888 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -101.39 -16.26 16.94 Favored 'General case' 0 C--N 1.282 -2.351 0 CA-C-N 109.567 -3.47 . . . . 1.0 113.249 -179.816 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 38.38 24.83 0.03 OUTLIER Glycine 0 N--CA 1.494 2.535 0 O-C-N 125.15 1.531 . . . . 1.0 112.613 -179.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.618 HG23 ' O ' ' A' ' 28' ' ' CYS . 0.0 OUTLIER -113.74 -83.45 0.6 Allowed 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 117.168 2.284 . . . . 1.0 117.168 -179.706 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.435 ' H ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' A' ' 10' ' ' SER . 3.1 tpp180 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 117.401 -1.285 . . . . 1.0 113.053 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 p -121.84 26.22 8.77 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 120.022 1.283 . . . . 1.0 109.836 179.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.512 ' HB2' ' HG2' ' A' ' 8' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.481 HG22 ' O ' ' A' ' 12' ' ' CYS . 0.0 OUTLIER -101.43 -66.98 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 N-CA-C 106.299 -1.741 . . . . 1.0 106.299 179.856 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.452 ' N ' HD13 ' A' ' 4' ' ' ILE . 3.2 t70 -162.8 -94.88 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 124.014 0.821 . . . . 1.0 110.01 179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.427 ' N ' ' CG ' ' A' ' 5' ' ' ASP . 60.1 p -19.17 -96.16 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 119.224 3.046 . . . . 1.0 119.224 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.572 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 5.2 pt -128.07 32.68 0.23 Allowed Pre-proline 0 N--CA 1.506 2.357 0 N-CA-C 114.832 1.419 . . . . 1.0 114.832 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 7' ' ' ILE . 72.1 Cg_endo -73.33 72.78 3.44 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 124.821 3.681 . . . . 1.0 109.264 -174.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -62.25 35.85 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 117.905 2.557 . . . . 1.0 117.905 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.5 ' O ' ' N ' ' A' ' 1' ' ' ARG . 32.5 p -173.26 -93.26 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 113.846 1.054 . . . . 1.0 113.846 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.3 ptp180 -145.11 36.83 1.13 Allowed 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 125.638 1.575 . . . . 1.0 110.559 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.791 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -97.67 136.54 37.89 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 118.458 -1.297 . . . . 1.0 108.454 -179.464 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.498 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -153.49 156.62 38.46 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.506 0.504 . . . . 1.0 110.168 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.714 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -73.56 -4.54 34.67 Favored 'General case' 0 C--N 1.301 -1.508 0 N-CA-C 107.512 -1.292 . . . . 1.0 107.512 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.2 OUTLIER -93.08 0.38 57.27 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 107.29 -1.374 . . . . 1.0 107.29 179.84 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.498 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.67 -60.32 0.17 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.172 0.92 . . . . 1.0 112.844 178.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.503 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 2.1 t -29.77 -50.67 0.11 Allowed 'General case' 0 N--CA 1.521 3.104 0 CA-C-O 122.85 1.31 . . . . 1.0 110.509 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.693 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppp? -172.55 76.73 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 111.062 -2.79 . . . . 1.0 112.506 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.551 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.8 m-70 -29.73 -81.33 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 116.09 1.885 . . . . 1.0 116.09 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.66 61.27 1.8 Allowed 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 116.965 2.209 . . . . 1.0 116.965 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.693 ' HB3' ' HG3' ' A' ' 18' ' ' LYS . . . -169.31 -7.03 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 112.107 -2.315 . . . . 1.0 109.599 179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.714 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 14.3 pttt -48.49 -54.29 14.8 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 116.497 -2.081 . . . . 1.0 108.906 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -59.85 -4.16 0.66 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 124.723 1.265 . . . . 1.0 113.301 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 -105.18 -41.81 5.46 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.965 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.746 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -92.06 -65.18 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 1 N-CA-C 99.802 -4.147 . . . . 1.0 99.802 179.192 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 177.66 -59.13 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.532 0 O-C-N 125.968 2.043 . . . . 1.0 106.756 179.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -157.15 -64.37 0.1 Allowed 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.484 -2.144 . . . . 1.0 111.738 -179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.9 OUTLIER -103.93 153.93 20.23 Favored 'General case' 0 N--CA 1.494 1.755 0 CA-C-N 112.766 -2.015 . . . . 1.0 107.259 -179.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.547 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -178.17 -89.35 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 124.957 1.303 . . . . 1.0 113.135 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -30.66 -49.67 0.12 Allowed 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 117.991 2.589 . . . . 1.0 117.991 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.503 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 44.2 m -104.4 -4.62 22.58 Favored 'General case' 0 N--CA 1.51 2.531 0 CA-C-N 112.786 -2.006 . . . . 1.0 111.303 -179.491 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.819 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 7.0 m -99.97 169.11 9.42 Favored 'General case' 0 C--N 1.282 -2.367 0 CA-C-N 111.113 -2.767 . . . . 1.0 114.725 -179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -118.11 36.45 3.63 Favored Glycine 0 N--CA 1.501 3.032 0 N-CA-C 109.082 -1.607 . . . . 1.0 109.082 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.54 ' CB ' HD11 ' A' ' 7' ' ' ILE . 11.9 t -109.64 -53.04 2.71 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 115.908 1.818 . . . . 1.0 115.908 -179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.473 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.5 mtp180 . . . . . 0 N--CA 1.507 2.386 0 N-CA-C 101.353 -3.573 . . . . 1.0 101.353 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.45 ' HA ' ' O ' ' A' ' 10' ' ' SER . 0.0 OUTLIER -139.52 -163.01 1.41 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 110.157 -3.202 . . . . 1.0 106.771 -178.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.608 ' HG2' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.93 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -100.49 -117.95 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.305 -1.336 0 N-CA-C 102.545 -3.132 . . . . 1.0 102.545 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.491 ' H ' HG12 ' A' ' 4' ' ' ILE . 2.1 t70 -81.55 20.87 0.85 Allowed 'General case' 0 C--N 1.297 -1.691 0 O-C-N 124.264 0.977 . . . . 1.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 1.057 HG21 ' SG ' ' A' ' 28' ' ' CYS . 0.2 OUTLIER -85.3 158.39 20.31 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 117.449 -1.7 . . . . 1.0 110.454 179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -59.94 -52.12 75.81 Favored Pre-proline 0 N--CA 1.51 2.556 0 N-CA-C 113.686 0.995 . . . . 1.0 113.686 -179.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.59 ' CG ' ' H ' ' A' ' 33' ' ' GLY . 1.0 OUTLIER -78.26 91.91 1.17 Allowed 'Trans proline' 0 C--N 1.311 -1.421 0 N-CA-C 102.756 -3.594 . . . . 1.0 102.756 -172.239 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.608 ' HA ' ' HG2' ' A' ' 3' ' ' ABA . 0.4 OUTLIER -68.13 55.42 0.07 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 125.343 1.652 . . . . 1.0 113.512 -179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.454 ' O ' ' N ' ' A' ' 3' ' ' ABA . 25.5 m -127.3 -118.69 0.26 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 112.798 -2.001 . . . . 1.0 105.825 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.56 72.26 1.38 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 120.015 1.28 . . . . 1.0 111.725 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.717 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -134.17 111.91 10.68 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 113.736 -1.574 . . . . 1.0 107.534 179.833 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.645 ' HB ' HD12 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -139.29 151.77 46.71 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 105.551 -2.018 . . . . 1.0 105.551 -179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.611 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -76.22 6.98 4.67 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 116.721 -1.992 . . . . 1.0 105.675 179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.539 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -95.38 1.4 54.23 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 105.45 -2.056 . . . . 1.0 105.45 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.492 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -156.28 -62.0 0.1 Allowed 'General case' 0 C--N 1.306 -1.304 0 O-C-N 124.023 0.827 . . . . 1.0 112.08 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.717 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -29.79 -44.44 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.895 0 O-C-N 124.668 1.23 . . . . 1.0 113.299 -179.162 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.479 ' HG3' ' CB ' ' A' ' 21' ' ' ALA . 8.1 tppt? -179.19 72.88 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.701 0 CA-C-N 112.307 -2.224 . . . . 1.0 110.411 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.506 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 84.9 m-70 -29.13 -81.95 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 116.825 2.158 . . . . 1.0 116.825 179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.6 71.04 4.06 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 123.177 1.465 . . . . 1.0 110.003 -179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.576 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -167.89 -11.38 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 112.861 -1.972 . . . . 1.0 110.697 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.611 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 25.0 pttm -47.57 -44.49 26.27 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 118.395 -1.322 . . . . 1.0 109.942 179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.464 ' CZ ' ' NH1' ' A' ' 24' ' ' ARG . 42.9 p90 -70.57 1.54 5.07 Favored 'General case' 0 N--CA 1.498 1.943 0 CA-C-N 114.294 -1.321 . . . . 1.0 113.241 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.504 ' NH2' ' HB2' ' A' ' 21' ' ' ALA . 2.9 ttp180 -107.54 -54.74 2.44 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-N 114.683 -1.144 . . . . 1.0 109.356 179.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.962 ' HG ' ' HB2' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -80.09 -71.25 0.46 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 103.596 -2.742 . . . . 1.0 103.596 179.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 m 177.98 -52.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 103.258 -2.867 . . . . 1.0 103.258 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -155.06 -50.89 0.09 Allowed 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 110.472 -3.058 . . . . 1.0 109.927 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 1.057 ' SG ' HG21 ' A' ' 6' ' ' THR . 1.6 m -120.69 146.27 46.6 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 115.295 1.591 . . . . 1.0 115.295 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.962 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 0.0 OUTLIER -162.85 -31.19 0.04 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 116.517 2.043 . . . . 1.0 116.517 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.48 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 1.2 tptm -100.26 -42.0 6.84 Favored 'General case' 0 N--CA 1.525 3.293 0 N-CA-C 119.601 3.186 . . . . 1.0 119.601 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.643 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 73.2 m -103.69 7.78 37.37 Favored 'General case' 0 N--CA 1.525 3.292 0 CA-C-O 125.598 2.618 . . . . 1.0 109.215 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.747 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -98.67 152.92 19.11 Favored 'General case' 0 C--N 1.282 -2.355 1 CA-C-N 108.105 -4.134 . . . . 1.0 112.481 -179.666 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.59 ' H ' ' CG ' ' A' ' 8' ' ' PRO . . . -116.77 41.94 1.99 Allowed Glycine 0 N--CA 1.489 2.225 0 N-CA-C 105.715 -2.954 . . . . 1.0 105.715 179.494 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.2 t -124.11 -61.51 1.35 Allowed 'General case' 0 N--CA 1.498 1.965 0 CA-C-N 114.846 -0.677 . . . . 1.0 110.612 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.555 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.3 mtp85 . . . . . 0 N--CA 1.505 2.317 0 N-CA-C 101.418 -3.549 . . . . 1.0 101.418 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.35 -142.27 0.15 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 111.423 -2.626 . . . . 1.0 105.975 -179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.577 ' HG1' ' HA ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.649 ' CG1' ' H ' ' A' ' 5' ' ' ASP 0.306 0.0 OUTLIER -119.29 -129.31 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.299 -1.623 1 N-CA-C 97.287 -5.079 . . . . 1.0 97.287 179.417 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.649 ' H ' ' CG1' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -130.31 67.67 1.47 Allowed 'General case' 0 C--N 1.292 -1.929 0 N-CA-C 107.498 -1.297 . . . . 1.0 107.498 -179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.556 HG21 ' SG ' ' A' ' 12' ' ' CYS . 5.1 t -101.08 -142.76 0.34 Allowed 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 113.423 -1.717 . . . . 1.0 106.59 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.421 ' H ' ' HD2' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -95.61 -57.34 0.2 Allowed Pre-proline 0 N--CA 1.488 1.472 0 N-CA-C 105.964 -1.865 . . . . 1.0 105.964 179.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.502 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 17.9 Cg_endo -68.42 82.62 0.51 Allowed 'Trans proline' 0 N--CA 1.488 1.168 0 C-N-CA 121.227 1.285 . . . . 1.0 109.518 170.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.577 ' HA ' ' HG1' ' A' ' 3' ' ' ABA . 13.5 tttt -72.81 69.81 0.95 Allowed 'General case' 0 C--N 1.296 -1.731 0 CA-C-O 122.016 0.912 . . . . 1.0 110.463 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 83.9 p -127.9 -99.67 0.36 Allowed 'General case' 0 N--CA 1.503 2.203 0 N-CA-C 114.607 1.336 . . . . 1.0 114.607 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.4 ptp180 -135.07 36.71 3.03 Favored 'General case' 0 C--N 1.307 -1.258 0 C-N-CA 124.595 1.158 . . . . 1.0 110.472 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.814 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.8 OUTLIER -112.66 134.24 54.28 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 106.708 -1.59 . . . . 1.0 106.708 179.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.544 ' HG1' ' CB ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -148.93 156.55 42.44 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 114.833 -1.076 . . . . 1.0 108.547 179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -79.66 -0.67 34.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 105.762 -1.94 . . . . 1.0 105.762 179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.544 ' CB ' ' HG1' ' A' ' 13' ' ' THR . 0.2 OUTLIER -91.59 1.76 56.92 Favored 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 105.927 -1.879 . . . . 1.0 105.927 179.686 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.482 ' HA ' ' NE2' ' A' ' 19' ' ' HIS . 0.0 OUTLIER -156.91 -56.63 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 178.439 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.9 t -30.37 -52.87 0.16 Allowed 'General case' 0 N--CA 1.511 2.602 0 CA-C-O 125.699 2.666 . . . . 1.0 111.881 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.601 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 1.2 tppm? -168.04 74.26 0.12 Allowed 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 109.92 -3.309 . . . . 1.0 111.601 -179.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.482 ' NE2' ' HA ' ' A' ' 16' ' ' GLN . 92.1 m-70 -29.66 -79.01 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 114.803 1.408 . . . . 1.0 114.803 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.86 27.68 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 118.462 2.764 . . . . 1.0 118.462 -179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.655 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -141.12 2.91 1.75 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 18.9 pttp -62.88 -21.7 66.17 Favored 'General case' 0 N--CA 1.497 1.914 0 C-N-CA 116.879 -1.929 . . . . 1.0 108.78 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -95.79 7.9 45.02 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 114.472 -1.24 . . . . 1.0 108.681 179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.529 HH21 ' HB3' ' A' ' 24' ' ' ARG . 4.5 mtp85 -111.05 -46.95 3.26 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 114.692 -1.14 . . . . 1.0 111.308 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.697 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.22 -88.02 0.25 Allowed 'General case' 0 N--CA 1.485 1.283 1 N-CA-C 96.999 -5.186 . . . . 1.0 96.999 179.177 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.478 ' H ' ' CD2' ' A' ' 25' ' ' LEU . 20.2 m -161.49 -46.42 0.04 OUTLIER 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 106.941 -1.503 . . . . 1.0 106.941 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -162.78 -58.14 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 CA-C-O 123.55 1.643 . . . . 1.0 111.736 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.791 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.4 m -116.25 131.44 56.94 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-N 111.078 -2.783 . . . . 1.0 112.745 -179.229 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.557 ' HB2' ' HG ' ' A' ' 25' ' ' LEU . 11.9 ttp85 -161.13 -49.63 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.183 0 N-CA-C 115.869 1.803 . . . . 1.0 115.869 179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.46 ' C ' ' H ' ' A' ' 32' ' ' CYS . 3.8 tmtt? -70.17 -79.07 0.07 Allowed 'General case' 0 N--CA 1.519 3.001 0 C-N-CA 117.708 -1.597 . . . . 1.0 107.487 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.595 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -59.49 -9.86 2.85 Favored 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 123.491 1.615 . . . . 1.0 109.672 179.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.814 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 2.5 m -98.73 -16.96 18.77 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 111.925 -2.398 . . . . 1.0 116.8 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 34.4 27.11 0.01 OUTLIER Glycine 0 N--CA 1.502 3.066 0 N-CA-C 115.362 0.905 . . . . 1.0 115.362 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.737 HG23 ' H ' ' A' ' 35' ' ' ABA . 1.8 t -102.09 -88.34 0.39 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 117.265 0.532 . . . . 1.0 110.765 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.737 ' H ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 3.7 mmm-85 . . . . . 0 N--CA 1.496 1.857 0 N-CA-C 106.016 -1.846 . . . . 1.0 106.016 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.7 t 179.95 -168.32 0.11 Allowed 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 105.913 -1.884 . . . . 1.0 105.913 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.714 ' HG3' ' O ' ' A' ' 12' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.958 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -107.63 -124.74 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 N-CA-C 106.565 -1.643 . . . . 1.0 106.565 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.478 ' H ' HG12 ' A' ' 4' ' ' ILE . 2.9 m-20 -85.57 35.02 0.59 Allowed 'General case' 0 C--N 1.295 -1.79 0 N-CA-C 113.777 1.029 . . . . 1.0 113.777 -179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.66 HG21 ' SG ' ' A' ' 12' ' ' CYS . 3.3 m -90.02 -170.15 2.68 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 106.424 -1.695 . . . . 1.0 106.424 179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.583 ' N ' HD13 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -91.81 -58.25 0.23 Allowed Pre-proline 0 N--CA 1.502 2.139 0 C-N-CA 119.304 -0.958 . . . . 1.0 111.615 -179.457 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HG2' ' SG ' ' A' ' 12' ' ' CYS . 27.2 Cg_endo -60.05 88.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.315 -1.229 0 C-N-CA 122.198 1.932 . . . . 1.0 107.665 172.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.0 71.04 0.15 Allowed 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 121.855 0.836 . . . . 1.0 109.281 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.6 m -140.21 -113.91 0.14 Allowed 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.526 HH21 ' CG2' ' A' ' 31' ' ' THR . 0.0 OUTLIER -127.67 75.05 1.57 Allowed 'General case' 0 C--N 1.307 -1.269 0 O-C-N 124.107 0.88 . . . . 1.0 108.687 -179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.774 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -142.24 123.12 14.4 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 103.748 -2.686 . . . . 1.0 103.748 179.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.637 HG23 ' CG ' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -152.38 143.3 23.0 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 116.881 -1.533 . . . . 1.0 107.924 179.767 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -59.07 -13.24 6.29 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 117.67 -1.612 . . . . 1.0 107.022 179.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -80.98 7.92 9.62 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-O 121.538 0.685 . . . . 1.0 110.836 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.637 ' CG ' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -164.8 -62.03 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 114.05 -1.432 . . . . 1.0 111.614 178.352 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.774 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -33.02 -50.02 0.26 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.874 1.321 . . . . 1.0 110.451 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -161.57 62.29 0.26 Allowed 'General case' 0 C--N 1.299 -1.628 0 CA-C-N 112.428 -2.169 . . . . 1.0 115.342 179.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.592 ' NE2' ' HA ' ' A' ' 16' ' ' GLN . 91.7 m-70 -29.56 -84.02 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 113.836 1.05 . . . . 1.0 113.836 179.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.13 71.73 4.62 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 124.51 2.1 . . . . 1.0 108.576 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.583 ' CB ' ' HE ' ' A' ' 24' ' ' ARG . . . 179.43 -10.0 0.0 OUTLIER 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 111.81 -2.45 . . . . 1.0 109.43 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.673 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 4.9 pttp -50.12 -45.64 53.12 Favored 'General case' 0 N--CA 1.496 1.838 0 C-N-CA 115.617 -2.433 . . . . 1.0 107.621 179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -70.57 7.01 1.19 Allowed 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 114.174 1.176 . . . . 1.0 114.174 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.583 ' HE ' ' CB ' ' A' ' 21' ' ' ALA . 3.3 mtp85 -108.73 -45.92 3.74 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.121 -1.066 . . . . 1.0 108.121 179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.705 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.75 -62.58 1.39 Allowed 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 105.937 -1.875 . . . . 1.0 105.937 179.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.486 ' HB2' ' HG1' ' A' ' 35' ' ' ABA . 1.1 m 178.55 -55.03 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 103.29 -2.856 . . . . 1.0 103.29 179.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -152.56 -60.19 0.15 Allowed 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 111.159 -2.746 . . . . 1.0 108.493 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.524 ' HB3' ' CB ' ' A' ' 32' ' ' CYS . 1.1 m -119.14 148.08 43.47 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-N 111.655 -2.52 . . . . 1.0 116.537 -179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.898 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 7.5 tmm_? -176.93 -22.53 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 117.327 2.343 . . . . 1.0 117.327 178.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.473 ' HB2' ' HG2' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -84.58 -37.98 20.5 Favored 'General case' 0 N--CA 1.526 3.333 0 CA-C-N 121.55 1.977 . . . . 1.0 114.405 -179.807 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.741 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 0.8 OUTLIER -103.9 -18.39 14.64 Favored 'General case' 0 N--CA 1.516 2.872 0 CA-C-O 123.727 1.727 . . . . 1.0 108.611 179.886 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.898 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -89.98 -40.33 12.41 Favored 'General case' 0 C--N 1.283 -2.316 0 CA-C-N 109.549 -3.478 . . . . 1.0 115.615 -179.507 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 42.86 33.54 1.68 Allowed Glycine 0 N--CA 1.51 3.576 0 N-CA-C 109.487 -1.445 . . . . 1.0 109.487 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.485 HG22 ' HB2' ' A' ' 32' ' ' CYS . 6.4 t -110.85 -35.27 6.01 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 112.428 -1.886 . . . . 1.0 114.917 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.585 ' C ' ' HG3' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 103.719 -2.697 . . . . 1.0 103.719 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -133.57 -157.86 0.84 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 111.409 -2.632 . . . . 1.0 105.754 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.837 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -107.0 -91.06 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 N-CA-C 106.034 -1.839 . . . . 1.0 106.034 179.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.837 ' H ' HD13 ' A' ' 4' ' ' ILE . 1.1 t70 -142.77 -92.2 0.12 Allowed 'General case' 0 N--CA 1.487 1.39 0 O-C-N 123.973 0.796 . . . . 1.0 110.435 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.547 ' CB ' HD13 ' A' ' 7' ' ' ILE . 39.7 p -19.41 -93.8 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.053 2.983 . . . . 1.0 119.053 -179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.618 ' N ' HD13 ' A' ' 7' ' ' ILE . 0.1 OUTLIER -132.73 47.5 2.78 Favored Pre-proline 0 N--CA 1.507 2.392 0 N-CA-C 116.632 2.086 . . . . 1.0 116.632 -179.767 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.431 ' HG3' ' H ' ' A' ' 4' ' ' ILE . 88.3 Cg_endo -78.42 98.02 1.17 Allowed 'Trans proline' 0 C--N 1.309 -1.547 0 C-N-CA 123.714 2.942 . . . . 1.0 107.688 178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 ttpm? -78.62 24.38 0.29 Allowed 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 122.025 0.917 . . . . 1.0 112.042 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER 179.21 -111.03 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 114.741 -1.118 . . . . 1.0 110.369 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -127.52 57.82 1.5 Allowed 'General case' 0 C--N 1.305 -1.34 0 CA-C-O 121.893 0.854 . . . . 1.0 110.954 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -111.88 137.64 49.57 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 102.782 -3.044 . . . . 1.0 102.782 179.465 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.622 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.6 OUTLIER -147.47 166.96 25.68 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 104.932 -2.247 . . . . 1.0 104.932 179.752 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.698 ' HB1' ' CB ' ' A' ' 22' ' ' LYS . . . -82.09 3.95 24.95 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 106.158 -1.793 . . . . 1.0 106.158 179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.582 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.1 OUTLIER -102.0 4.38 39.82 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 113.133 -1.849 . . . . 1.0 106.841 179.616 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.622 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -151.96 -58.02 0.15 Allowed 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 116.253 -0.43 . . . . 1.0 111.107 178.153 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.63 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 3.1 t -36.38 -50.14 0.75 Allowed 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.132 1.444 . . . . 1.0 110.637 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.585 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.74 69.45 0.06 Allowed 'General case' 0 C--N 1.302 -1.478 0 CA-C-N 112.183 -2.281 . . . . 1.0 114.858 179.998 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.582 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 87.5 m-70 -29.73 -67.75 0.08 Allowed 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 123.241 1.496 . . . . 1.0 112.095 179.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.1 p -78.88 55.46 1.74 Allowed 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 116.693 2.108 . . . . 1.0 116.693 -179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.738 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . 179.28 -4.39 0.0 OUTLIER 'General case' 0 C--N 1.288 -2.081 0 CA-C-N 111.445 -2.616 . . . . 1.0 108.965 179.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.698 ' CB ' ' HB1' ' A' ' 14' ' ' ALA . 5.7 pttp -48.91 -53.58 19.03 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 115.784 -2.366 . . . . 1.0 108.122 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' CE1' ' HD3' ' A' ' 24' ' ' ARG . 10.8 p90 -61.67 0.83 0.29 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 113.304 -1.771 . . . . 1.0 113.349 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 21' ' ' ALA . 2.3 mtp85 -109.45 -48.37 3.25 Favored 'General case' 0 C--N 1.299 -1.609 0 N-CA-C 114.01 1.115 . . . . 1.0 114.01 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.738 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -80.3 -63.01 1.51 Allowed 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 102.147 -3.279 . . . . 1.0 102.147 179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 177.6 -58.92 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.858 0 N-CA-C 102.349 -3.204 . . . . 1.0 102.349 179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -157.64 -64.13 0.09 Allowed 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 111.736 -2.484 . . . . 1.0 114.171 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.774 ' HB3' ' SG ' ' A' ' 32' ' ' CYS . 1.2 m -112.15 122.35 47.51 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 115.279 1.585 . . . . 1.0 115.279 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.63 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 2.0 tmm_? -149.46 -73.33 0.18 Allowed 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 117.946 2.572 . . . . 1.0 117.946 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -43.75 -31.68 0.86 Allowed 'General case' 0 N--CA 1.52 3.057 0 N-CA-C 117.677 2.473 . . . . 1.0 117.677 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.469 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.6 m -112.92 -2.29 14.34 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 125.523 1.764 . . . . 1.0 110.333 -179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.789 ' SG ' ' SG ' ' A' ' 12' ' ' CYS . 12.2 m -107.23 158.32 17.21 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 112.158 -2.292 . . . . 1.0 115.559 -179.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -114.32 36.49 3.96 Favored Glycine 0 N--CA 1.493 2.447 0 CA-C-N 113.574 -1.648 . . . . 1.0 110.56 -179.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.484 HG21 HG12 ' A' ' 7' ' ' ILE . 0.1 OUTLIER -118.42 -98.21 0.45 Allowed 'General case' 0 C--N 1.305 -1.368 0 N-CA-C 107.53 -1.285 . . . . 1.0 107.53 179.552 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.442 ' H ' HG23 ' A' ' 34' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.5 2.075 0 N-CA-C 101.457 -3.535 . . . . 1.0 101.457 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.402 ' C ' ' HA ' ' A' ' 11' ' ' ARG . 0.2 OUTLIER -170.6 -169.08 0.76 Allowed 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 103.52 -2.77 . . . . 1.0 103.52 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.719 HD13 ' H ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -121.05 -82.75 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 N-CA-C 105.224 -2.139 . . . . 1.0 105.224 179.759 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.719 ' H ' HD13 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -139.54 -86.14 0.23 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 124.254 0.971 . . . . 1.0 111.194 179.968 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.621 HG22 HD13 ' A' ' 4' ' ' ILE . 0.1 OUTLIER -18.52 -113.1 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 119.628 3.196 . . . . 1.0 119.628 -179.643 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.517 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 pt -129.39 44.68 1.45 Allowed Pre-proline 0 N--CA 1.504 2.234 0 O-C-N 120.914 -1.116 . . . . 1.0 112.532 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.582 ' HB3' ' SG ' ' A' ' 12' ' ' CYS . 83.4 Cg_endo -77.62 90.04 1.28 Allowed 'Trans proline' 0 C--N 1.31 -1.452 0 C-N-CA 123.815 3.01 . . . . 1.0 107.181 179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -69.3 32.0 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 114.779 1.4 . . . . 1.0 114.779 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER 179.69 -109.2 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.697 0.799 . . . . 1.0 109.744 179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.402 ' HA ' ' C ' ' A' ' 2' ' ' SER . 1.4 ptp180 -130.88 51.76 2.11 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-O 121.347 0.594 . . . . 1.0 112.042 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.812 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -99.87 128.1 45.98 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 106.122 -1.807 . . . . 1.0 106.122 179.793 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.561 ' OG1' ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -144.85 158.77 43.68 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 107.014 -1.476 . . . . 1.0 107.014 179.887 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.641 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -80.04 6.35 11.71 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 106.251 -1.759 . . . . 1.0 106.251 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.557 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -99.85 1.84 43.33 Favored 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 104.472 -2.418 . . . . 1.0 104.472 179.255 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.561 ' HG3' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.37 -62.26 0.16 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 113.674 0.99 . . . . 1.0 113.674 178.34 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.479 ' SG ' ' N ' ' A' ' 31' ' ' THR . 3.5 t -29.67 -48.89 0.09 Allowed 'General case' 0 N--CA 1.507 2.39 0 CA-C-O 123.493 1.616 . . . . 1.0 114.294 -179.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.533 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 14.6 tppt? -174.07 72.0 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 109.997 -3.274 . . . . 1.0 109.15 -179.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.557 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 80.0 m-70 -28.99 -77.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 117.394 2.368 . . . . 1.0 117.394 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -75.98 49.5 0.55 Allowed 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 116.079 1.881 . . . . 1.0 116.079 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.808 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.29 -3.36 0.42 Allowed 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 119.443 -0.903 . . . . 1.0 109.208 179.32 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.641 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 2.0 pttt -57.38 -29.44 64.05 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 116.836 -1.946 . . . . 1.0 110.248 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -84.09 0.72 47.28 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 115.123 -0.944 . . . . 1.0 110.058 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.429 HH21 ' HB3' ' A' ' 24' ' ' ARG . 13.3 mtp85 -107.25 -49.48 3.26 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 114.444 -1.253 . . . . 1.0 112.357 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.808 HD11 ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -96.1 -62.05 1.34 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 105.231 -2.137 . . . . 1.0 105.231 179.833 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.416 ' H ' HD22 ' A' ' 25' ' ' LEU . 1.2 m 178.77 -54.31 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 107.218 -1.401 . . . . 1.0 107.218 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.408 ' CG ' ' O ' ' A' ' 26' ' ' SER . 63.7 m-85 -163.24 -61.77 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 113.67 -1.604 . . . . 1.0 109.37 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.829 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -104.07 153.18 21.19 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 109.278 -3.601 . . . . 1.0 108.664 -179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.583 ' CB ' ' HG ' ' A' ' 25' ' ' LEU . 0.4 OUTLIER -178.14 -60.09 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 115.2 1.556 . . . . 1.0 115.2 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.444 ' C ' ' H ' ' A' ' 32' ' ' CYS . 25.7 tptt -70.56 -74.76 0.13 Allowed 'General case' 0 N--CA 1.519 2.983 0 C-N-CA 118.139 -1.425 . . . . 1.0 108.336 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.479 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 23.9 m -59.95 -10.77 4.45 Favored 'General case' 0 N--CA 1.512 2.667 0 CA-C-O 123.201 1.477 . . . . 1.0 110.355 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.829 ' SG ' ' CB ' ' A' ' 28' ' ' CYS . 3.9 m -96.71 -16.41 20.92 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 111.86 -2.427 . . . . 1.0 115.682 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 29.61 33.94 0.01 OUTLIER Glycine 0 N--CA 1.504 3.182 0 O-C-N 125.355 1.659 . . . . 1.0 112.77 -179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.481 ' N ' ' O ' ' A' ' 32' ' ' CYS . 4.8 t -99.38 -45.67 5.77 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 113.805 1.039 . . . . 1.0 113.805 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 10.3 ttm180 . . . . . 0 N--CA 1.494 1.74 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.44 ' H ' ' HA ' ' A' ' 5' ' ' ASP . 29.1 t 178.98 -151.94 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 101.918 -3.364 . . . . 1.0 101.918 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.672 ' C ' HD12 ' A' ' 4' ' ' ILE . 0.7 OUTLIER -84.75 -27.24 6.77 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 CA-C-N 112.36 -2.2 . . . . 1.0 109.293 179.777 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.568 ' HB2' ' HA ' ' A' ' 13' ' ' THR . 8.8 t70 46.82 -76.23 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.983 0 CA-C-N 111.058 -2.792 . . . . 1.0 114.145 -179.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.455 HG23 ' HB2' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -101.37 -80.04 0.5 Allowed 'General case' 0 C--N 1.295 -1.789 0 O-C-N 125.327 1.642 . . . . 1.0 109.257 -179.789 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.71 -63.23 0.03 OUTLIER Pre-proline 0 C--N 1.303 -1.444 0 CA-C-N 113.49 -1.686 . . . . 1.0 111.777 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.579 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 2.9 Cg_exo -62.77 124.65 14.47 Favored 'Trans proline' 0 C--N 1.313 -1.305 0 C-N-CA 123.462 2.775 . . . . 1.0 108.071 -157.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.39 66.64 8.08 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 103.804 -2.665 . . . . 1.0 103.804 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -125.6 -136.84 0.27 Allowed 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 106.227 -1.768 . . . . 1.0 106.227 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.411 ' H ' ' HG2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -137.88 71.62 1.4 Allowed 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 106.065 -1.828 . . . . 1.0 106.065 179.913 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.766 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 0.6 OUTLIER -136.79 136.22 38.67 Favored 'General case' 0 C--N 1.292 -1.899 0 N-CA-C 104.913 -2.255 . . . . 1.0 104.913 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.568 ' HA ' ' HB2' ' A' ' 5' ' ' ASP . 0.1 OUTLIER -158.4 160.03 36.42 Favored 'General case' 0 C--N 1.296 -1.755 0 C-N-CA 119.363 -0.935 . . . . 1.0 110.082 179.291 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.744 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -78.23 9.5 3.75 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 106.831 -1.544 . . . . 1.0 106.831 179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.562 ' O ' ' CE1' ' A' ' 19' ' ' HIS . 0.3 OUTLIER -108.03 1.99 22.83 Favored 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 104.305 -2.48 . . . . 1.0 104.305 179.468 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.553 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -153.01 -62.9 0.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 115.926 -0.579 . . . . 1.0 112.539 178.437 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.59 ' SG ' ' N ' ' A' ' 31' ' ' THR . 1.6 t -29.09 -57.99 0.14 Allowed 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 123.827 1.775 . . . . 1.0 111.806 -179.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.57 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 17.9 tppt? -165.93 73.53 0.18 Allowed 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 109.799 -3.364 . . . . 1.0 109.527 -179.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.562 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 83.9 m-70 -28.75 -79.03 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 119.685 3.217 . . . . 1.0 119.685 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.97 49.91 0.25 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 115.798 1.777 . . . . 1.0 115.798 -179.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.735 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -149.94 -1.51 0.42 Allowed 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.189 -0.945 . . . . 1.0 108.56 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.744 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 19.7 pttt -58.98 -25.41 63.56 Favored 'General case' 0 C--N 1.298 -1.636 0 C-N-CA 117.626 -1.63 . . . . 1.0 111.616 -179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -86.48 0.51 54.07 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.63 -1.168 . . . . 1.0 108.793 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.6 mtp85 -109.93 -48.62 3.18 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 114.109 -1.405 . . . . 1.0 110.791 179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.766 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -91.92 -69.21 0.75 Allowed 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 103.069 -2.938 . . . . 1.0 103.069 179.363 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.416 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 4.0 m 178.92 -49.04 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 107.039 -1.467 . . . . 1.0 107.039 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.663 ' CA ' ' HB2' ' A' ' 14' ' ' ALA . 24.6 m-85 -167.03 -84.17 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 105.696 -1.964 . . . . 1.0 105.696 -179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 32' ' ' CYS . 1.0 OUTLIER -81.48 153.16 27.0 Favored 'General case' 0 N--CA 1.5 2.051 0 CA-C-N 115.592 -0.731 . . . . 1.0 111.008 179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.531 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 3.2 tmm_? -171.52 -90.85 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.551 1.685 . . . . 1.0 115.551 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -33.07 -54.08 0.38 Allowed 'General case' 0 N--CA 1.518 2.954 0 N-CA-C 117.766 2.506 . . . . 1.0 117.766 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.59 ' N ' ' SG ' ' A' ' 17' ' ' CYS . 8.6 m -88.48 -6.21 57.76 Favored 'General case' 0 N--CA 1.514 2.749 0 C-N-CA 125.785 1.634 . . . . 1.0 110.791 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.777 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 4.1 m -102.33 -84.77 0.45 Allowed 'General case' 0 C--N 1.287 -2.149 0 CA-C-N 110.817 -2.902 . . . . 1.0 112.182 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.417 ' N ' ' O ' ' A' ' 29' ' ' ARG . . . 109.62 -0.52 30.66 Favored Glycine 0 N--CA 1.504 3.173 0 N-CA-C 109.272 -1.531 . . . . 1.0 109.272 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.427 HG23 ' HG3' ' A' ' 35' ' ' ABA . 10.3 t -72.27 -25.42 61.59 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-O 121.899 0.857 . . . . 1.0 108.843 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.441 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.121 0 N-CA-C 103.48 -2.785 . . . . 1.0 103.48 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -132.34 96.07 3.78 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.005 -1.078 . . . . 1.0 109.08 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.573 HD13 ' N ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -107.25 -35.71 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 125.803 1.94 . . . . 1.0 112.341 -179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.573 ' N ' HD13 ' A' ' 4' ' ' ILE . 1.2 t0 56.81 -82.72 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 105.535 -2.024 . . . . 1.0 105.535 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.484 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -103.01 -58.95 1.78 Allowed 'General case' 0 C--N 1.299 -1.622 0 O-C-N 123.982 0.801 . . . . 1.0 110.011 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.601 HD12 ' OG1' ' A' ' 34' ' ' THR . 0.0 OUTLIER -131.74 -54.32 0.03 OUTLIER Pre-proline 0 N--CA 1.498 1.943 0 N-CA-C 119.045 2.98 . . . . 1.0 119.045 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.538 ' O ' ' N ' ' A' ' 10' ' ' SER . 5.5 Cg_endo -76.13 55.19 4.45 Favored 'Trans proline' 0 N--CA 1.502 1.989 0 C-N-CA 123.509 2.806 . . . . 1.0 116.398 -161.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.444 ' CA ' ' HB ' ' A' ' 4' ' ' ILE . 0.1 OUTLIER -30.56 65.92 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.31 0 N-CA-C 118.582 2.808 . . . . 1.0 118.582 179.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.538 ' N ' ' O ' ' A' ' 8' ' ' PRO . 40.6 m -143.52 -97.09 0.11 Allowed 'General case' 0 C--N 1.298 -1.638 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.347 179.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -129.77 39.78 3.66 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 112.343 0.498 . . . . 1.0 112.343 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.789 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -122.45 129.33 51.92 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.823 -1.177 . . . . 1.0 107.823 -179.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.55 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -156.06 145.89 21.2 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-O 116.296 -1.811 . . . . 1.0 108.218 179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.66 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -62.88 -7.04 4.36 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 117.753 -1.579 . . . . 1.0 107.565 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.537 ' C ' ' HG2' ' A' ' 16' ' ' GLN . 1.0 OUTLIER -87.88 1.7 53.36 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.372 -0.83 . . . . 1.0 109.362 179.652 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.55 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -153.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.191 0.932 . . . . 1.0 110.531 179.343 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 0.1 OUTLIER -32.79 -42.06 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 114.506 1.299 . . . . 1.0 114.506 -179.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.55 ' HG3' ' HB3' ' A' ' 21' ' ' ALA . 2.2 tppp? 179.9 72.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 126.623 2.452 . . . . 1.0 112.141 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.528 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 88.6 m-70 -28.03 -91.67 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 118.348 2.722 . . . . 1.0 118.348 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 41.19 0.06 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.018 1.859 . . . . 1.0 116.018 -179.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.639 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -142.42 -1.52 1.16 Allowed 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.921 -1.14 . . . . 1.0 107.921 179.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.66 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 24.6 pttm -54.79 -36.82 65.31 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 117.35 -1.74 . . . . 1.0 109.263 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -79.02 2.11 21.62 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.232 -1.349 . . . . 1.0 111.517 -179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.7 mtp85 -108.5 -40.16 5.2 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.019 -0.991 . . . . 1.0 111.914 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.728 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -94.05 -79.21 0.42 Allowed 'General case' 0 N--CA 1.483 1.214 1 N-CA-C 96.77 -5.27 . . . . 1.0 96.77 179.078 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.6 m -170.02 -51.44 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 124.513 1.133 . . . . 1.0 108.006 179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -155.43 -71.37 0.12 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 112.591 -2.095 . . . . 1.0 107.437 -179.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . 0.5 OUTLIER -115.07 139.93 49.47 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 111.482 -2.599 . . . . 1.0 108.468 -179.745 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.87 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -151.84 -55.47 0.14 Allowed 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 118.426 2.75 . . . . 1.0 118.426 179.403 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.551 ' C ' ' H ' ' A' ' 32' ' ' CYS . 21.7 tptp -66.09 -81.95 0.03 OUTLIER 'General case' 0 N--CA 1.527 3.413 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.609 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.722 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 22.7 m -62.55 -5.11 2.32 Favored 'General case' 0 N--CA 1.528 3.455 0 CA-C-O 124.53 2.11 . . . . 1.0 111.517 179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.87 ' SG ' ' N ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -94.93 -31.55 13.61 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-N 109.444 -3.525 . . . . 1.0 112.04 -179.895 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 38.34 31.6 0.12 Allowed Glycine 0 N--CA 1.507 3.41 0 O-C-N 124.32 1.013 . . . . 1.0 111.247 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.601 ' OG1' HD12 ' A' ' 7' ' ' ILE . 0.6 OUTLIER -108.79 -38.62 5.57 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 113.752 -1.224 . . . . 1.0 112.924 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.553 ' C ' ' HG2' ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.6 ttm180 . . . . . 0 N--CA 1.496 1.851 0 N-CA-C 102.734 -3.061 . . . . 1.0 102.734 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 3' ' ' ABA . 5.6 m -118.66 58.16 0.84 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 125.071 1.482 . . . . 1.0 111.648 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ABA . . . . . 0.553 ' HG3' HG22 ' A' ' 4' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.721 HD13 ' N ' ' A' ' 5' ' ' ASP . 0.0 OUTLIER -101.55 -46.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 CA-C-N 112.311 -2.222 . . . . 1.0 110.488 179.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.721 ' N ' HD13 ' A' ' 4' ' ' ILE . 0.8 OUTLIER 55.44 -76.84 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.189 0 CA-C-N 120.259 1.39 . . . . 1.0 110.432 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' ILE . 0.2 OUTLIER -101.55 -106.47 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.082 -1.451 . . . . 1.0 107.082 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.512 ' N ' ' HD3' ' A' ' 8' ' ' PRO . 1.1 pp -140.49 47.16 1.08 Allowed Pre-proline 0 N--CA 1.499 2.019 0 N-CA-C 116.01 1.855 . . . . 1.0 116.01 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.751 ' HG3' ' SG ' ' A' ' 12' ' ' CYS . 29.4 Cg_endo -92.57 154.89 2.94 Favored 'Trans proline' 0 C--N 1.315 -1.225 1 C-N-CA 125.86 4.374 . . . . 1.0 107.416 175.925 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.22 35.16 2.32 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 113.021 0.748 . . . . 1.0 113.021 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 49.2 m -141.51 -106.42 0.14 Allowed 'General case' 0 N--CA 1.515 2.8 0 N-CA-C 119.007 2.965 . . . . 1.0 119.007 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.36 75.24 0.99 Allowed 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 105.855 -1.906 . . . . 1.0 105.855 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.872 ' HB2' ' SG ' ' A' ' 32' ' ' CYS . 14.5 p -124.14 42.11 3.33 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 123.258 1.504 . . . . 1.0 110.992 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.828 HG23 ' HG3' ' A' ' 16' ' ' GLN . 0.1 OUTLIER -57.27 140.61 49.4 Favored 'General case' 0 C--N 1.292 -1.903 0 C-N-CA 117.434 -1.706 . . . . 1.0 108.397 -179.504 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.743 ' HB1' ' HB3' ' A' ' 22' ' ' LYS . . . -49.27 -24.19 1.71 Allowed 'General case' 0 C--N 1.3 -1.585 0 O-C-N 124.794 1.309 . . . . 1.0 107.95 178.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.642 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -73.68 9.32 1.47 Allowed 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 120.949 0.404 . . . . 1.0 111.791 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.828 ' HG3' HG23 ' A' ' 13' ' ' THR . 0.0 OUTLIER -152.31 -59.33 0.15 Allowed 'General case' 0 C--N 1.296 -1.759 0 N-CA-C 108.648 -0.871 . . . . 1.0 108.648 178.615 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.544 ' SG ' ' HB ' ' A' ' 31' ' ' THR . 1.9 t -40.98 -48.52 3.2 Favored 'General case' 0 N--CA 1.517 2.908 0 CA-C-O 122.818 1.294 . . . . 1.0 111.972 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -169.32 71.63 0.08 Allowed 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 112.407 -2.179 . . . . 1.0 114.776 -179.739 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.6 ' CE1' ' O ' ' A' ' 15' ' ' PHE . 89.0 m-70 -28.76 -60.59 0.13 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.515 -1.22 . . . . 1.0 113.862 179.62 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.0 p -88.98 22.56 2.68 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 121.259 3.8 . . . . 1.0 121.259 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.615 ' HB3' ' CG ' ' A' ' 18' ' ' LYS . . . -140.88 3.77 1.85 Allowed 'General case' 0 C--N 1.296 -1.732 0 C-N-CA 117.245 -1.782 . . . . 1.0 106.901 178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.743 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -49.98 -55.74 13.44 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 116.169 -2.213 . . . . 1.0 108.423 -179.685 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.414 ' N ' ' HG3' ' A' ' 22' ' ' LYS . 10.8 p90 -60.78 -13.78 17.34 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 114.284 -1.325 . . . . 1.0 112.694 -179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -86.71 -42.41 13.39 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 120.459 -0.496 . . . . 1.0 110.467 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.736 ' N ' HD13 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -89.54 -58.33 2.56 Favored 'General case' 0 N--CA 1.483 1.21 0 N-CA-C 103.97 -2.604 . . . . 1.0 103.97 179.568 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 178.57 -62.35 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 106.524 -1.658 . . . . 1.0 106.524 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -150.95 -65.01 0.19 Allowed 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 110.493 -3.048 . . . . 1.0 114.671 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.793 ' CB ' ' SG ' ' A' ' 32' ' ' CYS . 1.3 m -101.22 143.52 31.19 Favored 'General case' 0 N--CA 1.514 2.757 0 CA-C-N 113.233 -1.803 . . . . 1.0 114.224 -179.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.749 ' N ' ' SG ' ' A' ' 32' ' ' CYS . 0.1 OUTLIER -167.76 -86.89 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 119.527 3.158 . . . . 1.0 119.527 179.593 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -40.37 -30.43 0.11 Allowed 'General case' 0 N--CA 1.525 3.32 0 N-CA-C 119.343 3.09 . . . . 1.0 119.343 -178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.544 ' HB ' ' SG ' ' A' ' 17' ' ' CYS . 88.4 m -112.59 -7.74 13.86 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 125.628 1.571 . . . . 1.0 109.758 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.872 ' SG ' ' HB2' ' A' ' 12' ' ' CYS . 4.3 m -97.6 124.76 42.0 Favored 'General case' 0 C--N 1.295 -1.788 0 CA-C-N 111.858 -2.428 . . . . 1.0 113.641 -179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.43 47.7 3.67 Favored Glycine 0 N--CA 1.5 2.93 0 C-N-CA 120.157 -1.021 . . . . 1.0 111.944 -179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.17 -85.41 0.6 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 118.445 -0.788 . . . . 1.0 110.303 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ABA . . . . . 0.563 ' C ' HH11 ' A' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_