data_1idg_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 1idg _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 full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 29.2 mm . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 t -134.47 112.38 15.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 CA-C-O 121.794 0.807 . . . . 0.0 109.22 -158.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.67 155.83 40.24 Favored 'General case' 0 CA--C 1.561 1.4 0 CA-C-N 114.092 -1.413 . . . . 0.0 112.415 166.7 -141.745 162.514 -88.302 109.267 2.008 108.562 175.379 -160.9 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -75.57 -175.36 2.82 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 164.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 40.8 p -83.15 89.3 6.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 119.802 -1.812 . . . . 0.0 109.153 157.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . 0.511 18.4 m 68.62 -95.56 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 121.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.07 125.18 5.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -139.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.393 28.6 p 72.29 -47.55 0.67 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 114.983 -1.008 . . . . 0.0 113.362 -150.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 m -110.72 155.59 42.0 Favored Pre-proline 0 CA--C 1.561 1.396 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -140.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.05 -43.24 0.59 Allowed 'Trans proline' 0 CA--C 1.574 2.52 0 C-N-CA 123.355 2.703 . . . . 0.0 116.745 154.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.3 mt -134.4 151.35 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-N 120.516 1.507 . . . . 0.0 113.141 -159.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . 0.339 0.3 OUTLIER -165.23 -103.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 151.206 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -148.42 114.06 5.67 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 173.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . 0.298 28.3 m -111.11 -140.94 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.737 -143.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.33 2.6 p 80.01 128.53 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 125.737 1.615 . . . . 0.0 112.449 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -96.72 95.89 2.41 Favored Pre-proline 0 CA--C 1.576 1.954 0 CA-C-O 117.136 -1.412 . . . . 0.0 107.231 159.124 176.378 154.198 -89.601 112.135 2.003 110.463 174.823 -142.07 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -100.43 -62.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.574 2.515 1 N-CA-C 123.023 4.201 . . . . 0.0 123.023 -146.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.92 -72.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.377 2.078 0 CA-C-N 126.694 3.426 . . . . 0.0 113.737 -154.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.22 -173.72 40.46 Favored Glycine 0 CA--C 1.566 3.245 0 CA-C-O 123.152 1.418 . . . . 0.0 112.593 129.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 177.08 125.0 0.04 OUTLIER 'General case' 1 CA--C 1.675 5.767 1 N-CA-C 47.852 -23.388 . . . . 0.0 47.852 23.545 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.471 2.2 m-20 82.88 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 1 CA-C-N 99.173 -8.194 . . . . 0.0 115.364 114.943 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.7 mt -124.79 148.69 48.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.895 . . . . 0.0 108.66 -134.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.51 ' SG ' HD12 ' A' ' 42' ' ' LEU . 7.2 t -84.42 62.94 7.53 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -169.917 -160.9 175.379 -88.302 108.562 2.008 109.267 162.514 -141.745 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -45.97 86.6 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 128.496 2.718 . . . . 0.0 117.722 -161.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.431 ' HE ' ' HD3' ' A' ' 67' ' ' PRO . 7.7 tmm_? -94.6 112.94 24.69 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.512 0.673 . . . . 0.0 111.347 -161.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 mttp -77.69 130.44 36.81 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.254 169.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 32.9 ttp -141.45 106.51 4.96 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -49.02 -68.94 0.13 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -172.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 56.33 76.9 0.27 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.708 0.803 . . . . 0.0 111.244 176.54 -141.776 -59.54 90.776 111.1 1.995 108.897 160.013 54.766 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -47.99 -44.06 30.23 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -166.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . 0.352 . . -155.58 -112.78 0.03 OUTLIER 'General case' 0 CA--C 1.624 3.802 1 CA-C-O 108.004 -5.76 . . . . 0.0 114.481 161.728 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . 0.422 5.1 m-85 5.09 -124.31 0.0 OUTLIER 'General case' 0 CA--C 1.606 3.13 4 N-CA-C 53.336 -21.357 . . . . 0.0 53.336 121.984 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . 0.286 19.8 p 50.99 94.03 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 2 CA-C-N 102.995 -6.457 . . . . 0.0 116.468 -112.596 54.766 160.013 90.776 108.897 1.995 111.1 -59.54 -141.776 3 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -77.91 -70.01 0.51 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.781 0.832 . . . . 0.0 111.096 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.9 m -116.26 74.85 0.92 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 163.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.58 160.11 43.8 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 123.513 1.625 . . . . 0.0 111.761 -167.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 125.93 -113.6 1.89 Allowed Glycine 0 CA--C 1.539 1.559 0 N-CA-C 105.257 -3.137 . . . . 0.0 105.257 -150.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.394 0.0 OUTLIER 39.59 57.74 2.12 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -156.233 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.4 t -152.75 109.71 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 1 N-CA-C 100.086 -4.042 . . . . 0.0 100.086 -175.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.425 HG11 ' HG1' ' B' ' 191' ' ' THR . 31.1 m -97.21 -170.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 CA-C-O 122.607 1.194 . . . . 0.0 107.873 150.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -167.44 -83.71 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 170.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.51 HD12 ' SG ' ' A' ' 23' ' ' CYS 0.394 0.5 OUTLIER 48.29 129.37 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 N-CA-C 118.901 2.926 . . . . 0.0 118.901 -178.074 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -150.25 36.93 0.94 Allowed Glycine 0 CA--C 1.547 2.037 0 CA-C-O 118.155 -1.358 . . . . 0.0 113.934 158.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 62.94 143.74 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.383 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -179.781 -142.07 174.823 -89.601 110.463 2.003 112.135 154.198 176.378 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.17 -178.93 4.74 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.723 1.249 . . . . 0.0 109.501 166.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -94.58 -4.85 47.12 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 170.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.3 t -162.73 157.88 22.23 Favored 'General case' 0 CA--C 1.569 1.692 0 CA-C-N 120.401 1.455 . . . . 0.0 111.192 -153.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.5 t -107.8 21.32 0.06 OUTLIER Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 -179.681 -156.673 23.94 80.914 112.023 2.012 111.081 152.788 19.166 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -71.8 4.03 3.41 Favored 'Trans proline' 0 C--N 1.379 2.182 0 CA-C-N 127.029 3.546 . . . . 0.0 117.864 172.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -80.92 115.19 20.28 Favored 'General case' 0 CA--C 1.561 1.396 0 CA-C-O 122.511 1.148 . . . . 0.0 109.8 160.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 178.4 16.64 0.0 OUTLIER 'General case' 0 CA--C 1.589 2.457 0 CA-C-N 113.004 -1.907 . . . . 0.0 111.777 -157.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -110.78 -168.96 0.15 Allowed Pre-proline 0 CA--C 1.591 2.526 0 O-C-N 119.881 -1.762 . . . . 0.0 108.655 -150.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.44 -70.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.939 0 CA-C-N 125.915 3.148 . . . . 0.0 114.76 -166.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -96.25 82.92 3.5 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 174.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -114.74 -138.75 0.37 Allowed 'General case' 0 CA--C 1.56 1.338 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 157.3 -75.79 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 103.725 -2.695 . . . . 0.0 103.725 -135.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.89 136.08 27.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.25 0 CA-C-O 122.308 1.051 . . . . 0.0 110.414 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.1 p -130.79 5.43 4.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 114.328 -1.305 . . . . 0.0 113.332 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . 0.379 0.2 OUTLIER 57.27 150.56 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.854 0 CA-C-N 120.858 1.663 . . . . 0.0 113.836 -154.877 19.166 152.788 80.914 111.081 2.012 112.023 23.94 -156.673 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.51 76.28 1.47 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.956 -1.09 . . . . 0.0 109.695 -169.463 -118.724 -61.821 -52.498 109.916 2.001 106.752 -145.234 -163.122 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 85.9 p -89.83 -171.25 3.1 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -172.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . 0.44 19.6 p 86.01 -65.24 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 125.012 1.325 . . . . 0.0 114.504 163.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.69 -157.99 0.86 Allowed 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 124.37 2.033 . . . . 0.0 106.997 175.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.97 85.32 0.0 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 122.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.09 -16.48 60.09 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 159.47 -163.122 -145.234 -52.498 106.752 2.001 109.916 -61.821 -118.724 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -58.05 123.17 63.26 Favored Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 126.994 2.118 . . . . 0.0 113.723 -166.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PRO . . . . . 0.431 ' HD3' ' HE ' ' A' ' 25' ' ' ARG . 93.0 Cg_endo -78.02 -91.11 0.0 OUTLIER 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 122.556 2.171 . . . . 0.0 111.078 177.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 29.8 m80 177.4 -172.04 0.07 OUTLIER Pre-proline 0 CA--C 1.59 2.519 0 C-N-CA 127.704 2.401 . . . . 0.0 104.966 -162.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.82 114.01 1.89 Allowed 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 115.569 -2.911 . . . . 0.0 109.912 130.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' HE3' ' H ' ' A' ' 71' ' ' GLN 0.444 0.0 OUTLIER -56.18 -68.86 0.17 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 115.476 -2.202 . . . . 0.0 111.605 -169.556 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.416 ' H ' ' HE3' ' A' ' 70' ' ' LYS 0.475 54.3 tt0 31.55 21.52 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 1 N-CA-C 125.375 5.324 . . . . 0.0 125.375 149.593 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -123.85 119.53 26.8 Favored Pre-proline 1 CA--C 1.673 5.708 1 N-CA-C 49.924 -22.621 . . . . 0.0 49.924 -163.981 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . 0.332 13.4 Cg_exo -116.06 -18.26 0.02 OUTLIER 'Trans proline' 2 C--N 1.485 7.732 1 N-CA-C 51.496 -23.309 . . . . 0.0 51.496 -105.649 . . . . . . . . 4 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.275 -2.813 2 O-C-N 111.218 -7.176 . . . . 0.0 120.159 -104.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 CA--C 1.561 1.384 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 19.15 110.17 0.0 OUTLIER 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 119.973 3.323 . . . . 0.0 119.973 106.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 183' ' ' GLY . . . . . 0.661 ' H ' ' HB3' ' B' ' 184' ' ' TRP . . . 159.55 72.87 0.02 OUTLIER Glycine 0 CA--C 1.54 1.615 0 N-CA-C 106.386 -2.686 . . . . 0.0 106.386 163.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 184' ' ' TRP . . . . . 0.661 ' HB3' ' H ' ' B' ' 183' ' ' GLY 0.693 0.0 OUTLIER 94.32 108.6 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 2 CA-C-N 126.546 5.173 . . . . 0.0 108.98 -4.481 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 41.82 99.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 117.398 2.37 . . . . 0.0 117.398 110.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . 0.485 20.5 t60 66.28 -170.03 0.2 Allowed 'General case' 0 N--CA 1.497 1.893 2 O-C-N 115.603 -4.435 . . . . 0.0 114.109 11.619 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 187' ' ' TRP . . . . . . . . . . . . 0.373 68.5 m95 -128.79 -101.01 0.33 Allowed 'General case' 0 CA--C 1.575 1.929 0 CA-C-O 114.986 -2.435 . . . . 0.0 110.181 -146.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 188' ' ' VAL . . . . . . . . . . . . 0.7 11.4 m 66.26 177.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.092 2 CA-C-N 132.466 6.939 . . . . 0.0 114.492 -19.734 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . 0.497 0.1 OUTLIER 93.71 63.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.506 2 O-C-N 111.59 -6.944 . . . . 0.0 114.83 -21.399 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' B' B ' 190' ' ' TYR . . . . . 0.569 ' HB2' ' H ' ' B' ' 192' ' ' CYS 0.363 0.1 OUTLIER -137.07 124.32 21.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 119.736 -1.852 . . . . 0.0 113.053 159.636 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' B' B ' 191' ' ' THR . . . . . 0.425 ' HG1' HG11 ' A' ' 40' ' ' VAL . 0.0 OUTLIER -32.35 -16.68 0.0 OUTLIER 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 121.098 3.74 . . . . 0.0 121.098 139.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 192' ' ' CYS . . . . . 0.569 ' H ' ' HB2' ' B' ' 190' ' ' TYR . 8.0 t -41.6 146.44 0.23 Allowed 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 120.958 1.708 . . . . 0.0 114.191 167.278 166.651 -69.797 104.131 112.686 2.043 115.02 -52.51 17.867 2 2 . 1 . 001 nuclear orig full ' B' B ' 193' ' ' CYS . . . . . . . . . . . . 0.334 0.1 OUTLIER 61.95 65.85 1.59 Allowed Pre-proline 0 CA--C 1.575 1.919 0 CA-C-N 112.879 -1.964 . . . . 0.0 111.71 164.837 17.867 -52.51 104.131 115.02 2.043 112.686 -69.797 166.651 3 3 . 1 . 001 nuclear orig full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.42 -175.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 124.032 3.155 . . . . 0.0 117.04 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 195' ' ' ASP . . . . . 0.521 ' H ' ' HA ' ' B' ' 196' ' ' THR . 36.9 t70 -98.12 -27.83 14.02 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 116.261 -1.828 . . . . 0.0 115.285 -108.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 196' ' ' THR . . . . . 0.521 ' HA ' ' H ' ' B' ' 195' ' ' ASP . 0.3 OUTLIER -118.1 166.61 13.21 Favored Pre-proline 0 CA--C 1.584 2.283 2 CA-C-N 129.238 5.472 . . . . 0.0 108.579 -13.275 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' B' B ' 197' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -88.79 -73.11 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.066 0 CA-C-N 123.82 2.4 . . . . 0.0 114.639 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' TYR . . . . . . . . . . . . 0.382 4.2 t80 . . . . . 0 CA--C 1.562 1.43 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 144.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 29.2 mm . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 t -134.47 112.38 15.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 CA-C-O 121.794 0.807 . . . . 0.0 109.22 -158.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.67 155.83 40.24 Favored 'General case' 0 CA--C 1.561 1.4 0 CA-C-N 114.092 -1.413 . . . . 0.0 112.415 166.7 -141.745 162.514 -88.302 109.267 2.008 108.562 175.379 -160.9 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -75.57 -175.36 2.82 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 164.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.518 HG23 HG12 ' A' ' 14' ' ' VAL . 40.8 p -83.15 89.3 6.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 119.802 -1.812 . . . . 0.0 109.153 157.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.425 HG22 ' HB ' ' A' ' 5' ' ' THR 0.511 18.4 m 68.62 -95.56 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 121.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.07 125.18 5.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -139.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.393 28.6 p 72.29 -47.55 0.67 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 114.983 -1.008 . . . . 0.0 113.362 -150.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 m -110.72 155.59 42.0 Favored Pre-proline 0 CA--C 1.561 1.396 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -140.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.05 -43.24 0.59 Allowed 'Trans proline' 0 CA--C 1.574 2.52 0 C-N-CA 123.355 2.703 . . . . 0.0 116.745 154.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.3 mt -134.4 151.35 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-N 120.516 1.507 . . . . 0.0 113.141 -159.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.433 ' HB2' HG21 ' A' ' 5' ' ' THR 0.339 0.3 OUTLIER -165.23 -103.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 151.206 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -148.42 114.06 5.67 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 173.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.518 HG12 HG23 ' A' ' 5' ' ' THR 0.298 28.3 m -111.11 -140.94 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.737 -143.044 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.33 2.6 p 80.01 128.53 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 125.737 1.615 . . . . 0.0 112.449 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -96.72 95.89 2.41 Favored Pre-proline 0 CA--C 1.576 1.954 0 CA-C-O 117.136 -1.412 . . . . 0.0 107.231 159.124 176.378 154.198 -89.601 112.135 2.003 110.463 174.823 -142.07 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -100.43 -62.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.574 2.515 1 N-CA-C 123.023 4.201 . . . . 0.0 123.023 -146.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.92 -72.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.377 2.078 0 CA-C-N 126.694 3.426 . . . . 0.0 113.737 -154.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.22 -173.72 40.46 Favored Glycine 0 CA--C 1.566 3.245 0 CA-C-O 123.152 1.418 . . . . 0.0 112.593 129.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 177.08 125.0 0.04 OUTLIER 'General case' 1 CA--C 1.675 5.767 1 N-CA-C 47.852 -23.388 . . . . 0.0 47.852 23.545 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.471 2.2 m-20 82.88 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 1 CA-C-N 99.173 -8.194 . . . . 0.0 115.364 114.943 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.414 HD22 ' CB ' ' A' ' 61' ' ' SER . 18.7 mt -124.79 148.69 48.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.895 . . . . 0.0 108.66 -134.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.497 ' SG ' HD13 ' A' ' 42' ' ' LEU . 7.2 t -84.42 62.94 7.53 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -169.917 -160.9 175.379 -88.302 108.562 2.008 109.267 162.514 -141.745 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -45.97 86.6 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 128.496 2.718 . . . . 0.0 117.722 -161.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -94.6 112.94 24.69 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.512 0.673 . . . . 0.0 111.347 -161.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.424 ' CG ' HG13 ' A' ' 57' ' ' VAL . 7.5 mttp -77.69 130.44 36.81 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.254 169.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 32.9 ttp -141.45 106.51 4.96 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -49.02 -68.94 0.13 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -172.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 56.33 76.9 0.27 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.708 0.803 . . . . 0.0 111.244 176.54 -141.776 -59.54 90.776 111.1 1.995 108.897 160.013 54.766 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -47.99 -44.06 30.23 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -166.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . 0.352 . . -155.58 -112.78 0.03 OUTLIER 'General case' 0 CA--C 1.624 3.802 1 CA-C-O 108.004 -5.76 . . . . 0.0 114.481 161.728 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . 0.422 5.1 m-85 5.09 -124.31 0.0 OUTLIER 'General case' 0 CA--C 1.606 3.13 4 N-CA-C 53.336 -21.357 . . . . 0.0 53.336 121.984 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . 0.286 19.8 p 50.99 94.03 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 2 CA-C-N 102.995 -6.457 . . . . 0.0 116.468 -112.596 54.766 160.013 90.776 108.897 1.995 111.1 -59.54 -141.776 3 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -77.91 -70.01 0.51 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.781 0.832 . . . . 0.0 111.096 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.9 m -116.26 74.85 0.92 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 163.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.58 160.11 43.8 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 123.513 1.625 . . . . 0.0 111.761 -167.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 125.93 -113.6 1.89 Allowed Glycine 0 CA--C 1.539 1.559 0 N-CA-C 105.257 -3.137 . . . . 0.0 105.257 -150.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.394 0.0 OUTLIER 39.59 57.74 2.12 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -156.233 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.4 t -152.75 109.71 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 1 N-CA-C 100.086 -4.042 . . . . 0.0 100.086 -175.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.21 -170.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 CA-C-O 122.607 1.194 . . . . 0.0 107.873 150.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -167.44 -83.71 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 170.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.497 HD13 ' SG ' ' A' ' 23' ' ' CYS 0.394 0.5 OUTLIER 48.29 129.37 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 N-CA-C 118.901 2.926 . . . . 0.0 118.901 -178.074 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -150.25 36.93 0.94 Allowed Glycine 0 CA--C 1.547 2.037 0 CA-C-O 118.155 -1.358 . . . . 0.0 113.934 158.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 62.94 143.74 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.383 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -179.781 -142.07 174.823 -89.601 110.463 2.003 112.135 154.198 176.378 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.17 -178.93 4.74 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.723 1.249 . . . . 0.0 109.501 166.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -94.58 -4.85 47.12 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 170.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.3 t -162.73 157.88 22.23 Favored 'General case' 0 CA--C 1.569 1.692 0 CA-C-N 120.401 1.455 . . . . 0.0 111.192 -153.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.5 t -107.8 21.32 0.06 OUTLIER Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 -179.681 -156.673 23.94 80.914 112.023 2.012 111.081 152.788 19.166 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -71.8 4.03 3.41 Favored 'Trans proline' 0 C--N 1.379 2.182 0 CA-C-N 127.029 3.546 . . . . 0.0 117.864 172.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -80.92 115.19 20.28 Favored 'General case' 0 CA--C 1.561 1.396 0 CA-C-O 122.511 1.148 . . . . 0.0 109.8 160.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 178.4 16.64 0.0 OUTLIER 'General case' 0 CA--C 1.589 2.457 0 CA-C-N 113.004 -1.907 . . . . 0.0 111.777 -157.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -110.78 -168.96 0.15 Allowed Pre-proline 0 CA--C 1.591 2.526 0 O-C-N 119.881 -1.762 . . . . 0.0 108.655 -150.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.44 -70.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.939 0 CA-C-N 125.915 3.148 . . . . 0.0 114.76 -166.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -96.25 82.92 3.5 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 174.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -114.74 -138.75 0.37 Allowed 'General case' 0 CA--C 1.56 1.338 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 157.3 -75.79 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 103.725 -2.695 . . . . 0.0 103.725 -135.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG13 ' CG ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -67.89 136.08 27.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.25 0 CA-C-O 122.308 1.051 . . . . 0.0 110.414 168.695 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.1 p -130.79 5.43 4.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 114.328 -1.305 . . . . 0.0 113.332 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . 0.379 0.2 OUTLIER 57.27 150.56 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.854 0 CA-C-N 120.858 1.663 . . . . 0.0 113.836 -154.877 19.166 152.788 80.914 111.081 2.012 112.023 23.94 -156.673 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.51 76.28 1.47 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.956 -1.09 . . . . 0.0 109.695 -169.463 -118.724 -61.821 -52.498 109.916 2.001 106.752 -145.234 -163.122 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.414 ' CB ' HD22 ' A' ' 22' ' ' LEU . 85.9 p -89.83 -171.25 3.1 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . 0.44 19.6 p 86.01 -65.24 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 125.012 1.325 . . . . 0.0 114.504 163.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.69 -157.99 0.86 Allowed 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 124.37 2.033 . . . . 0.0 106.997 175.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.97 85.32 0.0 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 122.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.09 -16.48 60.09 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 159.47 -163.122 -145.234 -52.498 106.752 2.001 109.916 -61.821 -118.724 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -58.05 123.17 63.26 Favored Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 126.994 2.118 . . . . 0.0 113.723 -166.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -78.02 -91.11 0.0 OUTLIER 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 122.556 2.171 . . . . 0.0 111.078 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 29.8 m80 177.4 -172.04 0.07 OUTLIER Pre-proline 0 CA--C 1.59 2.519 0 C-N-CA 127.704 2.401 . . . . 0.0 104.966 -162.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.82 114.01 1.89 Allowed 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 115.569 -2.911 . . . . 0.0 109.912 130.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.485 ' HE3' ' H ' ' A' ' 71' ' ' GLN 0.444 0.0 OUTLIER -56.18 -68.86 0.17 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 115.476 -2.202 . . . . 0.0 111.605 -169.556 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.485 ' H ' ' HE3' ' A' ' 70' ' ' LYS 0.475 54.3 tt0 31.55 21.52 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 1 N-CA-C 125.375 5.324 . . . . 0.0 125.375 149.593 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -123.85 119.53 26.8 Favored Pre-proline 1 CA--C 1.673 5.708 1 N-CA-C 49.924 -22.621 . . . . 0.0 49.924 -163.981 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . 0.332 13.4 Cg_exo -116.06 -18.26 0.02 OUTLIER 'Trans proline' 2 C--N 1.485 7.732 1 N-CA-C 51.496 -23.309 . . . . 0.0 51.496 -105.649 . . . . . . . . 4 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.275 -2.813 2 O-C-N 111.218 -7.176 . . . . 0.0 120.159 -104.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 CA--C 1.561 1.384 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 19.15 110.17 0.0 OUTLIER 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 119.973 3.323 . . . . 0.0 119.973 106.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 183' ' ' GLY . . . . . 0.653 ' H ' ' HB3' ' B' ' 184' ' ' TRP . . . 159.55 72.87 0.02 OUTLIER Glycine 0 CA--C 1.54 1.615 0 N-CA-C 106.386 -2.686 . . . . 0.0 106.386 163.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 184' ' ' TRP . . . . . 0.653 ' HB3' ' H ' ' B' ' 183' ' ' GLY 0.693 0.0 OUTLIER 94.32 108.6 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 2 CA-C-N 126.546 5.173 . . . . 0.0 108.98 -4.481 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 41.82 99.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 117.398 2.37 . . . . 0.0 117.398 110.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . 0.485 20.5 t60 66.28 -170.03 0.2 Allowed 'General case' 0 N--CA 1.497 1.893 2 O-C-N 115.603 -4.435 . . . . 0.0 114.109 11.619 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' B' B ' 187' ' ' TRP . . . . . 0.558 ' HB3' HG23 ' B' ' 188' ' ' VAL 0.373 68.5 m95 -128.79 -101.01 0.33 Allowed 'General case' 0 CA--C 1.575 1.929 0 CA-C-O 114.986 -2.435 . . . . 0.0 110.181 -146.3 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 188' ' ' VAL . . . . . 0.558 HG23 ' HB3' ' B' ' 187' ' ' TRP 0.7 11.4 m 66.26 177.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.092 2 CA-C-N 132.466 6.939 . . . . 0.0 114.492 -19.734 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . 0.497 0.1 OUTLIER 93.71 63.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.506 2 O-C-N 111.59 -6.944 . . . . 0.0 114.83 -21.399 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' B' B ' 190' ' ' TYR . . . . . 0.591 ' HB2' ' H ' ' B' ' 192' ' ' CYS 0.363 0.1 OUTLIER -137.07 124.32 21.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 119.736 -1.852 . . . . 0.0 113.053 159.636 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -32.35 -16.68 0.0 OUTLIER 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 121.098 3.74 . . . . 0.0 121.098 139.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 192' ' ' CYS . . . . . 0.591 ' H ' ' HB2' ' B' ' 190' ' ' TYR . 8.0 t -41.6 146.44 0.23 Allowed 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 120.958 1.708 . . . . 0.0 114.191 167.278 166.651 -69.797 104.131 112.686 2.043 115.02 -52.51 17.867 2 2 . 1 . 001 nuclear build full ' B' B ' 193' ' ' CYS . . . . . . . . . . . . 0.334 0.1 OUTLIER 61.95 65.85 1.59 Allowed Pre-proline 0 CA--C 1.575 1.919 0 CA-C-N 112.879 -1.964 . . . . 0.0 111.71 164.837 17.867 -52.51 104.131 115.02 2.043 112.686 -69.797 166.651 3 3 . 1 . 001 nuclear build full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.42 -175.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 124.032 3.155 . . . . 0.0 117.04 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -98.12 -27.83 14.02 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 116.261 -1.828 . . . . 0.0 115.285 -108.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 196' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -118.1 166.61 13.21 Favored Pre-proline 0 CA--C 1.584 2.283 2 CA-C-N 129.238 5.472 . . . . 0.0 108.579 -13.275 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 197' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -88.79 -73.11 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.066 0 CA-C-N 123.82 2.4 . . . . 0.0 114.639 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 198' ' ' TYR . . . . . . . . . . . . 0.382 4.2 t80 . . . . . 0 CA--C 1.562 1.43 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 144.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 29.2 mm . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 105.811 -1.922 . . . . 0.0 105.811 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 3.6 t -134.47 112.38 15.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 CA-C-O 121.794 0.807 . . . . 0.0 109.22 -158.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.67 155.83 40.24 Favored 'General case' 0 CA--C 1.561 1.4 0 CA-C-N 114.092 -1.413 . . . . 0.0 112.415 166.7 -141.745 162.514 -88.302 109.267 2.008 108.562 175.379 -160.9 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 14.0 m170 -75.57 -175.36 2.82 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 164.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.518 HG23 HG12 ' A' ' 14' ' ' VAL . 40.8 p -83.15 89.3 6.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 119.802 -1.812 . . . . 0.0 109.153 157.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.425 HG22 ' HB ' ' A' ' 5' ' ' THR 0.511 18.4 m 68.62 -95.56 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 116.4 2.0 . . . . 0.0 116.4 121.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.07 125.18 5.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -139.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . 0.393 28.6 p 72.29 -47.55 0.67 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-N 114.983 -1.008 . . . . 0.0 113.362 -150.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.1 m -110.72 155.59 42.0 Favored Pre-proline 0 CA--C 1.561 1.396 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 -140.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.05 -43.24 0.59 Allowed 'Trans proline' 0 CA--C 1.574 2.52 0 C-N-CA 123.355 2.703 . . . . 0.0 116.745 154.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.3 mt -134.4 151.35 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-N 120.516 1.507 . . . . 0.0 113.141 -159.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.433 ' HB2' HG21 ' A' ' 5' ' ' THR 0.339 0.3 OUTLIER -165.23 -103.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 151.206 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -148.42 114.06 5.67 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 107.084 -1.451 . . . . 0.0 107.084 173.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.518 HG12 HG23 ' A' ' 5' ' ' THR 0.298 28.3 m -111.11 -140.94 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.737 -143.044 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.33 2.6 p 80.01 128.53 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 125.737 1.615 . . . . 0.0 112.449 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 44.3 t -96.72 95.89 2.41 Favored Pre-proline 0 CA--C 1.576 1.954 0 CA-C-O 117.136 -1.412 . . . . 0.0 107.231 159.124 176.378 154.198 -89.601 112.135 2.003 110.463 174.823 -142.07 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -100.43 -62.47 0.0 OUTLIER 'Trans proline' 0 CA--C 1.574 2.515 1 N-CA-C 123.023 4.201 . . . . 0.0 123.023 -146.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.92 -72.87 0.02 OUTLIER 'Trans proline' 0 C--N 1.377 2.078 0 CA-C-N 126.694 3.426 . . . . 0.0 113.737 -154.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -93.22 -173.72 40.46 Favored Glycine 0 CA--C 1.566 3.245 0 CA-C-O 123.152 1.418 . . . . 0.0 112.593 129.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 177.08 125.0 0.04 OUTLIER 'General case' 1 CA--C 1.675 5.767 1 N-CA-C 47.852 -23.388 . . . . 0.0 47.852 23.545 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . 0.471 2.2 m-20 82.88 -133.25 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 1 CA-C-N 99.173 -8.194 . . . . 0.0 115.364 114.943 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.414 HD22 ' CB ' ' A' ' 61' ' ' SER . 18.7 mt -124.79 148.69 48.01 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.269 -0.895 . . . . 0.0 108.66 -134.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.497 ' SG ' HD13 ' A' ' 42' ' ' LEU . 7.2 t -84.42 62.94 7.53 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -169.917 -160.9 175.379 -88.302 108.562 2.008 109.267 162.514 -141.745 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -45.97 86.6 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 128.496 2.718 . . . . 0.0 117.722 -161.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -94.6 112.94 24.69 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.512 0.673 . . . . 0.0 111.347 -161.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.424 ' CG ' HG13 ' A' ' 57' ' ' VAL . 7.5 mttp -77.69 130.44 36.81 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 114.163 -1.381 . . . . 0.0 109.254 169.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 32.9 ttp -141.45 106.51 4.96 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 177.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 25.5 t-105 -49.02 -68.94 0.13 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 -172.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 56.33 76.9 0.27 Allowed 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.708 0.803 . . . . 0.0 111.244 176.54 -141.776 -59.54 90.776 111.1 1.995 108.897 160.013 54.766 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -47.99 -44.06 30.23 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -166.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . 0.352 . . -155.58 -112.78 0.03 OUTLIER 'General case' 0 CA--C 1.624 3.802 1 CA-C-O 108.004 -5.76 . . . . 0.0 114.481 161.728 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . 0.422 5.1 m-85 5.09 -124.31 0.0 OUTLIER 'General case' 0 CA--C 1.606 3.13 4 N-CA-C 53.336 -21.357 . . . . 0.0 53.336 121.984 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . 0.286 19.8 p 50.99 94.03 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 2 CA-C-N 102.995 -6.457 . . . . 0.0 116.468 -112.596 54.766 160.013 90.776 108.897 1.995 111.1 -59.54 -141.776 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 83.7 p -77.91 -70.01 0.51 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.781 0.832 . . . . 0.0 111.096 177.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.9 m -116.26 74.85 0.92 Allowed 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 163.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.58 160.11 43.8 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 123.513 1.625 . . . . 0.0 111.761 -167.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 125.93 -113.6 1.89 Allowed Glycine 0 CA--C 1.539 1.559 0 N-CA-C 105.257 -3.137 . . . . 0.0 105.257 -150.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . 0.394 0.0 OUTLIER 39.59 57.74 2.12 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 115.015 1.487 . . . . 0.0 115.015 -156.233 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.4 t -152.75 109.71 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.879 1 N-CA-C 100.086 -4.042 . . . . 0.0 100.086 -175.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 31.1 m -97.21 -170.46 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 CA-C-O 122.607 1.194 . . . . 0.0 107.873 150.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -167.44 -83.71 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 170.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.497 HD13 ' SG ' ' A' ' 23' ' ' CYS 0.394 0.5 OUTLIER 48.29 129.37 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.272 0 N-CA-C 118.901 2.926 . . . . 0.0 118.901 -178.074 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -150.25 36.93 0.94 Allowed Glycine 0 CA--C 1.547 2.037 0 CA-C-O 118.155 -1.358 . . . . 0.0 113.934 158.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 62.94 143.74 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.383 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -179.781 -142.07 174.823 -89.601 110.463 2.003 112.135 154.198 176.378 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -128.17 -178.93 4.74 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.723 1.249 . . . . 0.0 109.501 166.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -94.58 -4.85 47.12 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 170.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 14.3 t -162.73 157.88 22.23 Favored 'General case' 0 CA--C 1.569 1.692 0 CA-C-N 120.401 1.455 . . . . 0.0 111.192 -153.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.5 t -107.8 21.32 0.06 OUTLIER Pre-proline 0 CA--C 1.587 2.371 0 N-CA-C 119.499 3.148 . . . . 0.0 119.499 -179.681 -156.673 23.94 80.914 112.023 2.012 111.081 152.788 19.166 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -71.8 4.03 3.41 Favored 'Trans proline' 0 C--N 1.379 2.182 0 CA-C-N 127.029 3.546 . . . . 0.0 117.864 172.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.7 t -80.92 115.19 20.28 Favored 'General case' 0 CA--C 1.561 1.396 0 CA-C-O 122.511 1.148 . . . . 0.0 109.8 160.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 178.4 16.64 0.0 OUTLIER 'General case' 0 CA--C 1.589 2.457 0 CA-C-N 113.004 -1.907 . . . . 0.0 111.777 -157.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -110.78 -168.96 0.15 Allowed Pre-proline 0 CA--C 1.591 2.526 0 O-C-N 119.881 -1.762 . . . . 0.0 108.655 -150.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.44 -70.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.375 1.939 0 CA-C-N 125.915 3.148 . . . . 0.0 114.76 -166.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -96.25 82.92 3.5 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 107.143 -1.429 . . . . 0.0 107.143 174.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -114.74 -138.75 0.37 Allowed 'General case' 0 CA--C 1.56 1.338 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 157.3 -75.79 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 103.725 -2.695 . . . . 0.0 103.725 -135.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG13 ' CG ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -67.89 136.08 27.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.25 0 CA-C-O 122.308 1.051 . . . . 0.0 110.414 168.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 70.1 p -130.79 5.43 4.62 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 114.328 -1.305 . . . . 0.0 113.332 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . 0.379 0.2 OUTLIER 57.27 150.56 0.01 OUTLIER 'General case' 0 CA--C 1.573 1.854 0 CA-C-N 120.858 1.663 . . . . 0.0 113.836 -154.877 19.166 152.788 80.914 111.081 2.012 112.023 23.94 -156.673 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.51 76.28 1.47 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.956 -1.09 . . . . 0.0 109.695 -169.463 -118.724 -61.821 -52.498 109.916 2.001 106.752 -145.234 -163.122 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.414 ' CB ' HD22 ' A' ' 22' ' ' LEU . 85.9 p -89.83 -171.25 3.1 Favored 'General case' 0 CA--C 1.563 1.475 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -172.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . 0.44 19.6 p 86.01 -65.24 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 125.012 1.325 . . . . 0.0 114.504 163.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.69 -157.99 0.86 Allowed 'General case' 0 CA--C 1.569 1.706 0 CA-C-O 124.37 2.033 . . . . 0.0 106.997 175.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.97 85.32 0.0 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 122.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 8.9 t -63.09 -16.48 60.09 Favored 'General case' 0 CA--C 1.574 1.903 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 159.47 -163.122 -145.234 -52.498 106.752 2.001 109.916 -61.821 -118.724 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -58.05 123.17 63.26 Favored Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 126.994 2.118 . . . . 0.0 113.723 -166.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -78.02 -91.11 0.0 OUTLIER 'Trans proline' 0 CA--C 1.563 1.949 0 C-N-CA 122.556 2.171 . . . . 0.0 111.078 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 29.8 m80 177.4 -172.04 0.07 OUTLIER Pre-proline 0 CA--C 1.59 2.519 0 C-N-CA 127.704 2.401 . . . . 0.0 104.966 -162.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -59.82 114.01 1.89 Allowed 'Trans proline' 0 N--CA 1.49 1.27 0 O-C-N 115.569 -2.911 . . . . 0.0 109.912 130.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.485 ' HE3' ' H ' ' A' ' 71' ' ' GLN 0.444 0.0 OUTLIER -56.18 -68.86 0.17 Allowed 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 115.476 -2.202 . . . . 0.0 111.605 -169.556 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.485 ' H ' ' HE3' ' A' ' 70' ' ' LYS 0.475 54.3 tt0 31.55 21.52 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 1 N-CA-C 125.375 5.324 . . . . 0.0 125.375 149.593 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -123.85 119.53 26.8 Favored Pre-proline 1 CA--C 1.673 5.708 1 N-CA-C 49.924 -22.621 . . . . 0.0 49.924 -163.981 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . 0.332 13.4 Cg_exo -116.06 -18.26 0.02 OUTLIER 'Trans proline' 2 C--N 1.485 7.732 1 N-CA-C 51.496 -23.309 . . . . 0.0 51.496 -105.649 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.275 -2.813 2 O-C-N 111.218 -7.176 . . . . 0.0 120.159 -104.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 181' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 CA--C 1.561 1.384 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 182' ' ' ARG . . . . . . . . . . . . . 3.1 mtp180 19.15 110.17 0.0 OUTLIER 'General case' 0 CA--C 1.577 1.983 0 N-CA-C 119.973 3.323 . . . . 0.0 119.973 106.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 183' ' ' GLY . . . . . 0.653 ' H ' ' HB3' ' B' ' 184' ' ' TRP . . . 159.55 72.87 0.02 OUTLIER Glycine 0 CA--C 1.54 1.615 0 N-CA-C 106.386 -2.686 . . . . 0.0 106.386 163.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 184' ' ' TRP . . . . . 0.653 ' HB3' ' H ' ' B' ' 183' ' ' GLY 0.693 0.0 OUTLIER 94.32 108.6 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.776 2 CA-C-N 126.546 5.173 . . . . 0.0 108.98 -4.481 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' B' B ' 185' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 41.82 99.87 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 117.398 2.37 . . . . 0.0 117.398 110.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 186' ' ' HIS . . . . . . . . . . . . 0.485 20.5 t60 66.28 -170.03 0.2 Allowed 'General case' 0 N--CA 1.497 1.893 2 O-C-N 115.603 -4.435 . . . . 0.0 114.109 11.619 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' B' B ' 187' ' ' TRP . . . . . 0.558 ' HB3' HG23 ' B' ' 188' ' ' VAL 0.373 68.5 m95 -128.79 -101.01 0.33 Allowed 'General case' 0 CA--C 1.575 1.929 0 CA-C-O 114.986 -2.435 . . . . 0.0 110.181 -146.3 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 188' ' ' VAL . . . . . 0.558 HG23 ' HB3' ' B' ' 187' ' ' TRP 0.7 11.4 m 66.26 177.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.092 2 CA-C-N 132.466 6.939 . . . . 0.0 114.492 -19.734 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' B' B ' 189' ' ' TYR . . . . . . . . . . . . 0.497 0.1 OUTLIER 93.71 63.65 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.506 2 O-C-N 111.59 -6.944 . . . . 0.0 114.83 -21.399 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' B' B ' 190' ' ' TYR . . . . . 0.591 ' HB2' ' H ' ' B' ' 192' ' ' CYS 0.363 0.1 OUTLIER -137.07 124.32 21.81 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 119.736 -1.852 . . . . 0.0 113.053 159.636 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 191' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -32.35 -16.68 0.0 OUTLIER 'General case' 0 CA--C 1.57 1.722 0 N-CA-C 121.098 3.74 . . . . 0.0 121.098 139.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 192' ' ' CYS . . . . . 0.591 ' H ' ' HB2' ' B' ' 190' ' ' TYR . 8.0 t -41.6 146.44 0.23 Allowed 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 120.958 1.708 . . . . 0.0 114.191 167.278 166.651 -69.797 104.131 112.686 2.043 115.02 -52.51 17.867 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 193' ' ' CYS . . . . . . . . . . . . 0.334 0.1 OUTLIER 61.95 65.85 1.59 Allowed Pre-proline 0 CA--C 1.575 1.919 0 CA-C-N 112.879 -1.964 . . . . 0.0 111.71 164.837 17.867 -52.51 104.131 115.02 2.043 112.686 -69.797 166.651 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 194' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.42 -175.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 124.032 3.155 . . . . 0.0 117.04 177.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 195' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -98.12 -27.83 14.02 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-O 116.261 -1.828 . . . . 0.0 115.285 -108.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 196' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -118.1 166.61 13.21 Favored Pre-proline 0 CA--C 1.584 2.283 2 CA-C-N 129.238 5.472 . . . . 0.0 108.579 -13.275 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 197' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -88.79 -73.11 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.066 0 CA-C-N 123.82 2.4 . . . . 0.0 114.639 -176.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' TYR . . . . . . . . . . . . 0.382 4.2 t80 . . . . . 0 CA--C 1.562 1.43 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 144.35 . . . . . . . . 1 1 . 1 stop_ save_