data_1bbi_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 1bbi _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' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 120.856 0.36 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.7 71.92 6.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.865 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -87.18 8.16 25.12 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.71 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -15.96 30.19 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.383 -0.927 . . . . 0.0 110.8 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -13.51 22.57 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.535 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -46.44 120.84 6.06 Favored Pre-proline 0 C--N 1.298 -1.634 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.306 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -59.01 146.64 93.48 Favored 'Trans proline' 0 C--O 1.217 -0.53 0 CA-C-N 118.921 0.65 . . . . 0.0 110.853 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.9 p -135.03 -151.13 0.42 Allowed 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 119.374 -0.93 . . . . 0.0 112.006 -179.941 68.186 170.365 -73.375 103.61 2.02 104.032 93.627 -141.535 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -165.42 166.51 18.42 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 118.666 -1.214 . . . . 0.0 112.857 -179.787 -116.321 -58.736 174.281 104.385 2.006 102.222 -167.312 168.693 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.86 -76.64 0.23 Allowed 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -99.01 101.52 12.93 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.25 151.74 19.62 Favored 'General case' 0 C--N 1.292 -1.905 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.82 -179.728 -116.473 -87.259 -142.968 104.888 2.012 102.999 -88.606 -121.708 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -160.82 144.76 13.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.794 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.509 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -125.56 145.51 50.09 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.66 179.928 -116.91 58.292 -125.628 104.767 2.026 104.618 77.594 -120.009 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -100.78 145.88 27.96 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.508 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -64.89 106.48 1.24 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.141 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -151.01 -169.5 3.4 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.686 -0.806 . . . . 0.0 110.383 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -151.83 97.33 3.06 Favored Pre-proline 0 N--CA 1.485 1.322 0 C-N-CA 119.071 -1.052 . . . . 0.0 111.732 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -64.55 164.42 55.54 Favored 'Cis proline' 0 C--O 1.212 -0.819 0 C-N-CA 124.85 -0.896 . . . . 0.0 111.272 -0.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.23 154.14 74.94 Favored 'Trans proline' 0 C--N 1.325 -0.709 0 C-N-CA 121.263 1.308 . . . . 0.0 110.948 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.509 ' O ' ' SG ' ' A' ' 14' ' ' CYS . 5.5 mt-30 -101.05 154.93 18.3 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -154.11 115.23 4.08 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 116.402 -2.119 . . . . 0.0 114.928 -179.852 -120.009 77.594 -125.628 104.618 2.026 104.767 58.292 -116.91 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -111.44 152.6 27.21 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 113.27 -1.786 . . . . 0.0 107.278 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.58 ' SG ' ' N ' ' A' ' 25' ' ' SER . 11.9 t -144.48 178.86 7.64 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 118.584 -1.247 . . . . 0.0 111.593 -179.86 168.693 -167.312 174.281 102.222 2.006 104.385 -58.736 -116.321 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 24' ' ' CYS . 1.8 t 47.88 42.24 15.83 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 118.69 -1.204 . . . . 0.0 107.834 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -37.6 -73.15 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.649 -1.614 . . . . 0.0 113.106 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.17 158.08 16.56 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 119.316 -0.954 . . . . 0.0 113.066 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.36 129.91 20.15 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.141 -1.391 . . . . 0.0 108.92 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -86.83 36.6 0.72 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.437 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -162.72 -88.34 0.02 OUTLIER 'General case' 0 C--N 1.28 -2.448 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.732 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.7 p -160.48 179.72 8.37 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.195 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.4 m -98.31 -159.5 0.74 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.429 -0.909 . . . . 0.0 111.567 179.999 -28.995 -156.789 -113.633 103.748 2.012 104.065 -137.084 -122.215 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.37 -142.03 0.16 Allowed 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.388 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.19 39.62 1.33 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.151 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -137.63 23.27 2.91 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.361 -0.936 . . . . 0.0 110.926 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 4.3 t -144.75 100.48 3.51 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.051 179.833 -155.896 107.11 130.454 104.372 2.013 104.07 39.206 -168.889 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -73.71 -31.08 63.22 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.114 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 61.6 m -112.26 64.72 0.63 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.052 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -101.46 135.97 42.07 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.568 -0.853 . . . . 0.0 111.652 179.86 -122.215 -137.084 -113.633 104.065 2.012 103.748 -156.789 -28.995 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.417 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 2.0 mp -102.14 140.1 21.5 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 CA-C-N 114.957 -1.019 . . . . 0.0 108.978 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.64 135.58 21.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 117.91 -1.516 . . . . 0.0 113.726 179.976 -123.091 58.98 -120.478 104.72 2.018 104.369 97.255 -142.993 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -104.05 104.25 14.17 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 113.451 -1.704 . . . . 0.0 108.989 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.3 87.21 0.17 Allowed 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.809 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.4 m -143.18 -165.97 2.2 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.737 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.95 112.66 3.89 Favored Pre-proline 0 C--N 1.301 -1.512 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.455 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -64.05 134.32 17.76 Favored 'Cis proline' 0 N--CA 1.485 1.004 0 CA-C-N 119.174 0.741 . . . . 0.0 112.433 -0.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.2 161.81 3.97 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.261 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -140.63 137.3 33.5 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.983 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 40' ' ' ILE . 0.5 OUTLIER -152.15 163.19 39.87 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 118.125 -1.43 . . . . 0.0 113.014 -179.976 -142.993 97.255 -120.478 104.369 2.018 104.72 58.98 -123.091 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.73 157.86 43.75 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.318 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 22.2 t -129.88 109.11 10.65 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.18 179.95 -168.889 39.206 130.454 104.07 2.013 104.372 107.11 -155.896 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.77 -5.38 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.218 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -53.32 154.1 3.52 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 118.241 -1.383 . . . . 0.0 108.752 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 3.1 mt -137.08 150.6 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 C-N-CA 118.885 -1.126 . . . . 0.0 112.228 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.544 ' OG1' ' N ' ' A' ' 56' ' ' ASP . 0.7 OUTLIER -130.11 -173.84 3.16 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.982 179.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.544 ' N ' ' OG1' ' A' ' 55' ' ' THR . 73.2 m-20 -122.02 26.2 8.69 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.688 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.502 ' CZ ' ' OG1' ' A' ' 55' ' ' THR . 0.4 OUTLIER -153.33 -6.5 0.18 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.434 -1.306 . . . . 0.0 112.643 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 59' ' ' TYR . 0.0 OUTLIER 55.37 103.03 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 118.962 -1.095 . . . . 0.0 111.005 179.945 -121.708 -88.606 -142.968 102.999 2.012 104.888 -87.259 -116.473 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' O ' ' O ' ' A' ' 58' ' ' CYS . 4.8 m-85 -47.94 178.73 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.116 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -94.84 153.5 39.99 Favored Pre-proline 0 N--CA 1.492 1.647 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.252 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -43.32 157.5 0.11 Allowed 'Trans proline' 0 C--O 1.215 -0.636 0 C-N-CA 121.328 1.352 . . . . 0.0 111.575 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.63 -153.39 0.38 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.646 -0.822 . . . . 0.0 112.443 -179.878 -141.535 93.627 -73.375 104.032 2.02 103.61 170.365 68.186 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.4 mttp 63.02 65.87 1.29 Allowed Pre-proline 0 C--N 1.294 -1.812 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.967 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PRO . . . . . 0.413 ' O ' ' CB ' ' A' ' 65' ' ' SER . 2.7 Cg_exo -56.05 -155.72 0.01 OUTLIER 'Trans proline' 0 C--O 1.214 -0.692 0 C-N-CA 121.841 1.694 . . . . 0.0 112.175 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.413 ' CB ' ' O ' ' A' ' 64' ' ' PRO . 0.7 OUTLIER 68.12 -146.35 0.13 Allowed 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.823 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -158.9 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.9 -1.12 . . . . 0.0 109.958 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.409 ' O ' ' O ' ' A' ' 68' ' ' ASP . 3.4 m-20 -78.63 -121.3 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.052 -1.059 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.409 ' O ' ' O ' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -53.58 -171.84 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.667 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -154.11 -55.54 0.11 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.812 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -82.69 -76.89 0.25 Allowed 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.994 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 116.28 -1.819 . . . . 0.0 110.876 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 120.856 0.36 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.7 71.92 6.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.865 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -87.18 8.16 25.12 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.71 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -15.96 30.19 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.383 -0.927 . . . . 0.0 110.8 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -13.51 22.57 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.535 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -46.44 120.84 6.06 Favored Pre-proline 0 C--N 1.298 -1.634 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.306 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -59.01 146.64 93.48 Favored 'Trans proline' 0 C--O 1.217 -0.53 0 CA-C-N 118.921 0.65 . . . . 0.0 110.853 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.9 p -135.03 -151.13 0.42 Allowed 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 119.374 -0.93 . . . . 0.0 112.006 -179.941 68.186 170.365 -73.375 103.61 2.02 104.032 93.627 -141.535 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -165.42 166.51 18.42 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 118.666 -1.214 . . . . 0.0 112.857 -179.787 -116.321 -58.736 174.281 104.385 2.006 102.222 -167.312 168.693 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.86 -76.64 0.23 Allowed 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -99.01 101.52 12.93 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.25 151.74 19.62 Favored 'General case' 0 C--N 1.292 -1.905 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.82 -179.728 -116.473 -87.259 -142.968 104.888 2.012 102.999 -88.606 -121.708 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -160.82 144.76 13.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.794 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.509 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -125.56 145.51 50.09 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.66 179.928 -116.91 58.292 -125.628 104.767 2.026 104.618 77.594 -120.009 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -100.78 145.88 27.96 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.508 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -64.89 106.48 1.24 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.141 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -151.01 -169.5 3.4 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.686 -0.806 . . . . 0.0 110.383 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -151.83 97.33 3.06 Favored Pre-proline 0 N--CA 1.485 1.322 0 C-N-CA 119.071 -1.052 . . . . 0.0 111.732 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -64.55 164.42 55.54 Favored 'Cis proline' 0 C--O 1.212 -0.819 0 C-N-CA 124.85 -0.896 . . . . 0.0 111.272 -0.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.23 154.14 74.94 Favored 'Trans proline' 0 C--N 1.325 -0.709 0 C-N-CA 121.263 1.308 . . . . 0.0 110.948 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.509 ' O ' ' SG ' ' A' ' 14' ' ' CYS . 5.5 mt-30 -101.05 154.93 18.3 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.417 ' H ' HG22 ' A' ' 54' ' ' ILE . 0.0 OUTLIER -154.11 115.23 4.08 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 116.402 -2.119 . . . . 0.0 114.928 -179.852 -120.009 77.594 -125.628 104.618 2.026 104.767 58.292 -116.91 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -111.44 152.6 27.21 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 113.27 -1.786 . . . . 0.0 107.278 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.58 ' SG ' ' N ' ' A' ' 25' ' ' SER . 11.9 t -144.48 178.86 7.64 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 118.584 -1.247 . . . . 0.0 111.593 -179.86 168.693 -167.312 174.281 102.222 2.006 104.385 -58.736 -116.321 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 24' ' ' CYS . 1.8 t 47.88 42.24 15.83 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 118.69 -1.204 . . . . 0.0 107.834 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -37.6 -73.15 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.649 -1.614 . . . . 0.0 113.106 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.17 158.08 16.56 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 119.316 -0.954 . . . . 0.0 113.066 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.36 129.91 20.15 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.141 -1.391 . . . . 0.0 108.92 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -86.83 36.6 0.72 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.437 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -162.72 -88.34 0.02 OUTLIER 'General case' 0 C--N 1.28 -2.448 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.732 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.7 p -160.48 179.72 8.37 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.195 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.4 m -98.31 -159.5 0.74 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.429 -0.909 . . . . 0.0 111.567 179.999 -28.995 -156.789 -113.633 103.748 2.012 104.065 -137.084 -122.215 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.831 ' CE1' ' HB3' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -137.37 -142.03 0.16 Allowed 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.388 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.19 39.62 1.33 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.151 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.831 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . . . -137.63 23.27 2.91 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.361 -0.936 . . . . 0.0 110.926 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 4.3 t -144.75 100.48 3.51 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.051 179.833 -155.896 107.11 130.454 104.372 2.013 104.07 39.206 -168.889 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -73.71 -31.08 63.22 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.114 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 61.6 m -112.26 64.72 0.63 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.052 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -101.46 135.97 42.07 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.568 -0.853 . . . . 0.0 111.652 179.86 -122.215 -137.084 -113.633 104.065 2.012 103.748 -156.789 -28.995 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.417 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 2.0 mp -102.14 140.1 21.5 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 CA-C-N 114.957 -1.019 . . . . 0.0 108.978 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.64 135.58 21.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 117.91 -1.516 . . . . 0.0 113.726 179.976 -123.091 58.98 -120.478 104.72 2.018 104.369 97.255 -142.993 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . . . -104.05 104.25 14.17 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 113.451 -1.704 . . . . 0.0 108.989 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.3 87.21 0.17 Allowed 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.809 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.4 m -143.18 -165.97 2.2 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.737 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.95 112.66 3.89 Favored Pre-proline 0 C--N 1.301 -1.512 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.455 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -64.05 134.32 17.76 Favored 'Cis proline' 0 N--CA 1.485 1.004 0 CA-C-N 119.174 0.741 . . . . 0.0 112.433 -0.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.2 161.81 3.97 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.261 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 60.2 mt-30 -140.63 137.3 33.5 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.983 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 40' ' ' ILE . 0.5 OUTLIER -152.15 163.19 39.87 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 118.125 -1.43 . . . . 0.0 113.014 -179.976 -142.993 97.255 -120.478 104.369 2.018 104.72 58.98 -123.091 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.73 157.86 43.75 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.318 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 22.2 t -129.88 109.11 10.65 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.18 179.95 -168.889 39.206 130.454 104.07 2.013 104.372 107.11 -155.896 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.77 -5.38 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.218 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -53.32 154.1 3.52 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 118.241 -1.383 . . . . 0.0 108.752 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . 0.417 HG22 ' H ' ' A' ' 22' ' ' CYS . 3.1 mt -137.08 150.6 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 C-N-CA 118.885 -1.126 . . . . 0.0 112.228 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.544 ' OG1' ' N ' ' A' ' 56' ' ' ASP . 0.7 OUTLIER -130.11 -173.84 3.16 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.982 179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.544 ' N ' ' OG1' ' A' ' 55' ' ' THR . 73.2 m-20 -122.02 26.2 8.69 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.688 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.487 ' CZ ' ' OG1' ' A' ' 55' ' ' THR . 0.4 OUTLIER -153.33 -6.5 0.18 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.434 -1.306 . . . . 0.0 112.643 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 59' ' ' TYR . 0.0 OUTLIER 55.37 103.03 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 118.962 -1.095 . . . . 0.0 111.005 179.945 -121.708 -88.606 -142.968 102.999 2.012 104.888 -87.259 -116.473 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' O ' ' O ' ' A' ' 58' ' ' CYS . 4.8 m-85 -47.94 178.73 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.116 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -94.84 153.5 39.99 Favored Pre-proline 0 N--CA 1.492 1.647 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.252 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -43.32 157.5 0.11 Allowed 'Trans proline' 0 C--O 1.215 -0.636 0 C-N-CA 121.328 1.352 . . . . 0.0 111.575 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.63 -153.39 0.38 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.646 -0.822 . . . . 0.0 112.443 -179.878 -141.535 93.627 -73.375 104.032 2.02 103.61 170.365 68.186 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.4 mttp 63.02 65.87 1.29 Allowed Pre-proline 0 C--N 1.294 -1.812 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.967 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PRO . . . . . 0.413 ' O ' ' CB ' ' A' ' 65' ' ' SER . 2.7 Cg_exo -56.05 -155.72 0.01 OUTLIER 'Trans proline' 0 C--O 1.214 -0.692 0 C-N-CA 121.841 1.694 . . . . 0.0 112.175 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.413 ' CB ' ' O ' ' A' ' 64' ' ' PRO . 0.7 OUTLIER 68.12 -146.35 0.13 Allowed 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.823 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -158.9 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.9 -1.12 . . . . 0.0 109.958 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.409 ' O ' ' O ' ' A' ' 68' ' ' ASP . 3.4 m-20 -78.63 -121.3 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.052 -1.059 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.409 ' O ' ' O ' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -53.58 -171.84 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.667 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -154.11 -55.54 0.11 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.812 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -82.69 -76.89 0.25 Allowed 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.994 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 116.28 -1.819 . . . . 0.0 110.876 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 120.856 0.36 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -90.7 71.92 6.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.865 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -87.18 8.16 25.12 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.71 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.31 -15.96 30.19 Favored 'General case' 0 C--N 1.306 -1.314 0 C-N-CA 119.383 -0.927 . . . . 0.0 110.8 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -96.79 -13.51 22.57 Favored 'General case' 0 C--N 1.3 -1.549 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.535 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 5.7 tptt -46.44 120.84 6.06 Favored Pre-proline 0 C--N 1.298 -1.634 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.306 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -59.01 146.64 93.48 Favored 'Trans proline' 0 C--O 1.217 -0.53 0 CA-C-N 118.921 0.65 . . . . 0.0 110.853 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 22.9 p -135.03 -151.13 0.42 Allowed 'General case' 0 C--N 1.307 -1.256 0 C-N-CA 119.374 -0.93 . . . . 0.0 112.006 -179.941 68.186 170.365 -73.375 103.61 2.02 104.032 93.627 -141.535 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -165.42 166.51 18.42 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 118.666 -1.214 . . . . 0.0 112.857 -179.787 -116.321 -58.736 174.281 104.385 2.006 102.222 -167.312 168.693 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -143.86 -76.64 0.23 Allowed 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -99.01 101.52 12.93 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -93.25 151.74 19.62 Favored 'General case' 0 C--N 1.292 -1.905 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.82 -179.728 -116.473 -87.259 -142.968 104.888 2.012 102.999 -88.606 -121.708 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -160.82 144.76 13.6 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.581 -0.848 . . . . 0.0 110.794 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.509 ' SG ' ' O ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -125.56 145.51 50.09 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 119.665 -0.814 . . . . 0.0 111.66 179.928 -116.91 58.292 -125.628 104.767 2.026 104.618 77.594 -120.009 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -100.78 145.88 27.96 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.508 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -64.89 106.48 1.24 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.141 -179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -151.01 -169.5 3.4 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.686 -0.806 . . . . 0.0 110.383 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -151.83 97.33 3.06 Favored Pre-proline 0 N--CA 1.485 1.322 0 C-N-CA 119.071 -1.052 . . . . 0.0 111.732 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -64.55 164.42 55.54 Favored 'Cis proline' 0 C--O 1.212 -0.819 0 C-N-CA 124.85 -0.896 . . . . 0.0 111.272 -0.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.23 154.14 74.94 Favored 'Trans proline' 0 C--N 1.325 -0.709 0 C-N-CA 121.263 1.308 . . . . 0.0 110.948 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.509 ' O ' ' SG ' ' A' ' 14' ' ' CYS . 5.5 mt-30 -101.05 154.93 18.3 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.417 ' H ' HG22 ' A' ' 54' ' ' ILE . 0.0 OUTLIER -154.11 115.23 4.08 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 116.402 -2.119 . . . . 0.0 114.928 -179.852 -120.009 77.594 -125.628 104.618 2.026 104.767 58.292 -116.91 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.0 ttp180 -111.44 152.6 27.21 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 113.27 -1.786 . . . . 0.0 107.278 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.58 ' SG ' ' N ' ' A' ' 25' ' ' SER . 11.9 t -144.48 178.86 7.64 Favored 'General case' 0 C--N 1.293 -1.867 0 C-N-CA 118.584 -1.247 . . . . 0.0 111.593 -179.86 168.693 -167.312 174.281 102.222 2.006 104.385 -58.736 -116.321 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.58 ' N ' ' SG ' ' A' ' 24' ' ' CYS . 1.8 t 47.88 42.24 15.83 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 118.69 -1.204 . . . . 0.0 107.834 -179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -37.6 -73.15 0.05 OUTLIER 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.649 -1.614 . . . . 0.0 113.106 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.17 158.08 16.56 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 119.316 -0.954 . . . . 0.0 113.066 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.36 129.91 20.15 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 114.141 -1.391 . . . . 0.0 108.92 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -86.83 36.6 0.72 Allowed 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.437 -179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -162.72 -88.34 0.02 OUTLIER 'General case' 0 C--N 1.28 -2.448 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.732 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 53.7 p -160.48 179.72 8.37 Favored 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.195 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.4 m -98.31 -159.5 0.74 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.429 -0.909 . . . . 0.0 111.567 179.999 -28.995 -156.789 -113.633 103.748 2.012 104.065 -137.084 -122.215 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.831 ' CE1' ' HB3' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -137.37 -142.03 0.16 Allowed 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.388 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.19 39.62 1.33 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.151 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.831 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . . . -137.63 23.27 2.91 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.361 -0.936 . . . . 0.0 110.926 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 39' ' ' CYS . 4.3 t -144.75 100.48 3.51 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.051 179.833 -155.896 107.11 130.454 104.372 2.013 104.07 39.206 -168.889 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.5 mttm -73.71 -31.08 63.22 Favored 'General case' 0 C--N 1.283 -2.318 0 CA-C-N 114.911 -1.041 . . . . 0.0 111.114 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 61.6 m -112.26 64.72 0.63 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.052 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.594 ' SG ' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -101.46 135.97 42.07 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.568 -0.853 . . . . 0.0 111.652 179.86 -122.215 -137.084 -113.633 104.065 2.012 103.748 -156.789 -28.995 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.417 ' O ' ' SG ' ' A' ' 49' ' ' CYS . 2.0 mp -102.14 140.1 21.5 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.948 0 CA-C-N 114.957 -1.019 . . . . 0.0 108.978 179.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -147.64 135.58 21.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 117.91 -1.516 . . . . 0.0 113.726 179.976 -123.091 58.98 -120.478 104.72 2.018 104.369 97.255 -142.993 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . . . -104.05 104.25 14.17 Favored 'General case' 0 C--N 1.289 -2.034 0 CA-C-N 113.451 -1.704 . . . . 0.0 108.989 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.4 mt -67.3 87.21 0.17 Allowed 'General case' 0 C--N 1.306 -1.318 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.809 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.4 m -143.18 -165.97 2.2 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.737 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -147.95 112.66 3.89 Favored Pre-proline 0 C--N 1.301 -1.512 0 C-N-CA 119.724 -0.791 . . . . 0.0 110.455 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -64.05 134.32 17.76 Favored 'Cis proline' 0 N--CA 1.485 1.004 0 CA-C-N 119.174 0.741 . . . . 0.0 112.433 -0.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.2 161.81 3.97 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.798 -0.761 . . . . 0.0 111.261 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 60.2 mt-30 -140.63 137.3 33.5 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.516 -0.874 . . . . 0.0 109.983 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.417 ' SG ' ' O ' ' A' ' 40' ' ' ILE . 0.5 OUTLIER -152.15 163.19 39.87 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 118.125 -1.43 . . . . 0.0 113.014 -179.976 -142.993 97.255 -120.478 104.369 2.018 104.72 58.98 -123.091 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -147.73 157.86 43.75 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.318 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 22.2 t -129.88 109.11 10.65 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.18 179.95 -168.889 39.206 130.454 104.07 2.013 104.372 107.11 -155.896 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -92.77 -5.38 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.218 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -53.32 154.1 3.52 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 118.241 -1.383 . . . . 0.0 108.752 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.417 HG22 ' H ' ' A' ' 22' ' ' CYS . 3.1 mt -137.08 150.6 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 C-N-CA 118.885 -1.126 . . . . 0.0 112.228 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.544 ' OG1' ' N ' ' A' ' 56' ' ' ASP . 0.7 OUTLIER -130.11 -173.84 3.16 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 114.577 -1.192 . . . . 0.0 108.982 179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.544 ' N ' ' OG1' ' A' ' 55' ' ' THR . 73.2 m-20 -122.02 26.2 8.69 Favored 'General case' 0 N--CA 1.494 1.749 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.688 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.487 ' CZ ' ' OG1' ' A' ' 55' ' ' THR . 0.4 OUTLIER -153.33 -6.5 0.18 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 118.434 -1.306 . . . . 0.0 112.643 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 59' ' ' TYR . 0.0 OUTLIER 55.37 103.03 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 118.962 -1.095 . . . . 0.0 111.005 179.945 -121.708 -88.606 -142.968 102.999 2.012 104.888 -87.259 -116.473 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.426 ' O ' ' O ' ' A' ' 58' ' ' CYS . 4.8 m-85 -47.94 178.73 0.0 OUTLIER 'General case' 0 C--N 1.298 -1.664 0 CA-C-N 115.278 -0.874 . . . . 0.0 111.116 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -94.84 153.5 39.99 Favored Pre-proline 0 N--CA 1.492 1.647 0 C-N-CA 119.464 -0.894 . . . . 0.0 111.252 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -43.32 157.5 0.11 Allowed 'Trans proline' 0 C--O 1.215 -0.636 0 C-N-CA 121.328 1.352 . . . . 0.0 111.575 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.63 -153.39 0.38 Allowed 'General case' 0 C--N 1.301 -1.514 0 C-N-CA 119.646 -0.822 . . . . 0.0 112.443 -179.878 -141.535 93.627 -73.375 104.032 2.02 103.61 170.365 68.186 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.4 mttp 63.02 65.87 1.29 Allowed Pre-proline 0 C--N 1.294 -1.812 0 CA-C-N 114.168 -1.378 . . . . 0.0 109.967 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PRO . . . . . 0.413 ' O ' ' CB ' ' A' ' 65' ' ' SER . 2.7 Cg_exo -56.05 -155.72 0.01 OUTLIER 'Trans proline' 0 C--O 1.214 -0.692 0 C-N-CA 121.841 1.694 . . . . 0.0 112.175 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.413 ' CB ' ' O ' ' A' ' 64' ' ' PRO . 0.7 OUTLIER 68.12 -146.35 0.13 Allowed 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.823 -179.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.99 -158.9 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.9 -1.12 . . . . 0.0 109.958 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.409 ' O ' ' O ' ' A' ' 68' ' ' ASP . 3.4 m-20 -78.63 -121.3 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.052 -1.059 . . . . 0.0 110.523 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.409 ' O ' ' O ' ' A' ' 67' ' ' ASP . 0.0 OUTLIER -53.58 -171.84 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.667 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -154.11 -55.54 0.11 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.812 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -82.69 -76.89 0.25 Allowed 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.994 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASN . . . . . 0.539 ' ND2' ' H ' ' A' ' 71' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 116.28 -1.819 . . . . 0.0 110.876 179.998 . . . . . . . . 2 2 . 1 stop_ save_