data_1vmc_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 1vmc _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 8' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 N--CA 1.496 1.869 0 N-CA-C 108.734 -0.839 . . . . 5.0099999999999998 108.734 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 73.4 m -87.84 148.35 43.33 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.72999999999999998 109.125 -179.611 -63.102 -62.648 -81.349 103.291 2.016 103.849 -119.932 -54.399 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -57.31 -30.35 87.33 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 120.974 1.116 . . . . 0.97999999999999998 110.468 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 28.2 m -124.13 137.81 54.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.217 -0.927 . . . . 0.73999999999999999 110.359 -179.922 -79.011 -72.314 -80.179 100.572 2.013 102.677 -106.41 -76.729 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -97.85 -64.01 1.08 Allowed 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 108.31 -0.996 . . . . 4.4500000000000002 108.31 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -108.9 142.6 39.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.9 -1.125 . . . . 1.6599999999999999 108.29 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -107.86 141.64 39.15 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.296 -0.878 . . . . 0.92000000000000004 109.14 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -101.73 132.96 47.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.392 -0.817 . . . . 2.29 109.347 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -106.03 -0.31 24.99 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.257 -0.646 . . . . 0.97999999999999998 109.257 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -108.2 34.47 3.59 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.523 -0.735 . . . . 0.97999999999999998 110.399 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.33 147.06 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 N-CA-C 108.498 -0.927 . . . . 1.1299999999999999 108.498 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -123.43 163.47 20.78 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 109.208 -0.664 . . . . 1.2 109.208 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttt-85 -62.29 -41.57 98.61 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.344 -0.848 . . . . 4.1399999999999997 110.202 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.59 -23.87 12.15 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.912 -1.117 . . . . 1.1200000000000001 110.498 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -98.46 -7.22 28.91 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.95 -1.094 . . . . 0.44 109.947 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.5 t -106.23 144.47 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.302 -0.874 . . . . 1.1000000000000001 109.368 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -96.74 -39.14 9.61 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.348 -0.845 . . . . 2.48 109.001 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.5 p-80 -156.75 154.7 30.4 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.189 -0.944 . . . . 1.3600000000000001 109.787 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.2 mt -110.93 134.95 52.15 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 109.258 -0.645 . . . . 1.0900000000000001 109.258 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -112.93 126.07 55.08 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.784 -0.821 . . . . 2.21 108.784 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 14.5 mm -94.12 135.54 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.372 -0.83 . . . . 1.22 109.856 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.0 mt -130.74 118.78 21.37 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.168 -0.958 . . . . 1.1899999999999999 108.889 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -98.46 79.83 2.54 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.982 -1.073 . . . . 2.0499999999999998 108.741 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 35' ' ' ALA . 44.4 p -98.02 110.76 57.17 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.608 -0.683 . . . . 1.27 110.794 -178.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -69.03 2.62 2.97 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.611 1.541 . . . . 1.3100000000000001 111.146 178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -97.27 -18.1 19.4 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.528 -0.915 . . . . 1.98 108.528 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.459 ' O ' ' CB ' ' A' ' 35' ' ' ALA . 57.6 m -139.08 -0.3 1.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.482 -0.761 . . . . 0.45000000000000001 109.806 -179.664 -54.399 -119.932 -81.349 103.849 2.016 103.291 -62.648 -63.102 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 34' ' ' CYS . . . 85.74 -154.24 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 109.403 -0.591 . . . . 1.0900000000000001 109.403 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.9 tp -87.27 129.75 34.86 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.089 -1.007 . . . . 1.1499999999999999 109.694 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -138.03 146.28 42.85 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.709 -0.849 . . . . 1.1899999999999999 108.709 178.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.1 mt -123.9 133.8 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.729 -0.607 . . . . 1.0700000000000001 109.77 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 56.9 t -112.13 138.98 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 107.928 -1.138 . . . . 1.1899999999999999 107.928 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -137.25 154.67 50.09 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.431 -0.793 . . . . 1.0800000000000001 108.88 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -111.05 138.77 47.06 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.442 -0.786 . . . . 3.2999999999999998 110.527 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 55.4 mt -74.4 125.35 28.33 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.201 -1.0 . . . . 1.1299999999999999 108.74 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -64.5 -35.16 80.04 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.865 -0.522 . . . . 2.4100000000000001 109.927 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -53.33 -72.2 0.06 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 1.8200000000000001 110.497 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -96.62 5.54 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.193 -0.942 . . . . 2.21 111.621 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.2 m120 59.82 29.69 19.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.0 -1.063 . . . . 2.1099999999999999 110.06 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -78.07 175.12 10.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.314 -0.867 . . . . 3.9700000000000002 110.181 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -112.44 112.09 23.39 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 107.738 -1.208 . . . . 1.28 107.738 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.463 HG13 ' N ' ' A' ' 50' ' ' CYS . 54.9 t -125.46 157.1 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 N-CA-C 108.413 -0.958 . . . . 1.1599999999999999 108.413 -178.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.463 ' N ' HG13 ' A' ' 49' ' ' VAL . 47.1 m -101.05 134.86 43.41 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.146 -0.971 . . . . 0.68999999999999995 108.613 179.725 -76.729 -106.41 -80.179 102.677 2.013 100.572 -72.314 -79.011 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.412 HG23 HD11 ' A' ' 51' ' ' ILE . 20.0 mm -111.58 138.21 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.571 0.7 . . . . 1.1299999999999999 110.099 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 54' ' ' LYS . 53.7 t0 -67.58 122.58 83.94 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.636 -0.665 . . . . 0.97999999999999998 109.825 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -66.37 11.58 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 121.425 1.417 . . . . 0.44 112.705 -179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 52' ' ' ASP . 13.5 mttp -99.4 -3.63 33.36 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.064 -1.023 . . . . 2.4700000000000002 110.612 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.58 140.52 49.85 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.527 -1.358 . . . . 1.1200000000000001 109.366 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -65.62 -42.13 91.91 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.028 -1.045 . . . . 2.75 112.132 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 53.4 p-90 -61.68 -24.16 66.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.596 -1.315 . . . . 0.68999999999999995 109.621 -178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 69.1 mt -68.56 -45.16 82.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 C-N-CA 119.216 -0.994 . . . . 1.1399999999999999 108.506 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.8 -39.95 95.83 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.434 -0.906 . . . . 2.9500000000000002 108.964 -179.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -62.85 -39.78 95.44 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.178 -0.951 . . . . 2.23 109.06 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -61.27 -41.69 97.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.267 -0.896 . . . . 1.0700000000000001 109.551 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.9 mt -70.48 -31.2 68.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.398 -0.814 . . . . 1.3500000000000001 109.807 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -72.26 -37.14 69.16 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.878 -0.786 . . . . 2.46 108.878 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -78.09 -20.15 52.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.464 -0.773 . . . . 2.8799999999999999 109.896 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -92.01 -21.1 20.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.054 -1.029 . . . . 1.54 109.907 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.3 mt -86.0 -46.53 10.43 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.112 -0.993 . . . . 2.0699999999999998 110.826 -179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.6 m-20 -70.19 -35.67 74.1 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.799 -1.188 . . . . 3.79 109.982 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 N--CA 1.493 1.711 0 O-C-N 120.929 -1.107 . . . . 4.6100000000000003 109.217 179.235 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 N--CA 1.496 1.869 0 N-CA-C 108.734 -0.839 . . . . 4.3700000000000001 108.734 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.401 ' HB3' HE22 ' A' ' 37' ' ' GLN . 73.4 m -87.84 148.35 43.33 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.63 109.125 -179.611 -63.102 -62.648 -81.349 103.291 2.016 103.849 -119.932 -54.399 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -57.31 -30.35 87.33 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 120.974 1.116 . . . . 0.57999999999999996 110.468 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.598 ' SG ' HG22 ' A' ' 39' ' ' VAL . 28.2 m -124.13 137.81 54.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.217 -0.927 . . . . 0.73999999999999999 110.359 -179.922 -79.011 -72.314 -80.179 100.572 2.013 102.677 -106.41 -76.729 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -97.85 -64.01 1.08 Allowed 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 108.31 -0.996 . . . . 3.79 108.31 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -108.9 142.6 39.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.9 -1.125 . . . . 1.46 108.29 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -107.86 141.64 39.15 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.296 -0.878 . . . . 0.73999999999999999 109.14 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -101.73 132.96 47.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.392 -0.817 . . . . 2.29 109.347 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -106.03 -0.31 24.99 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.257 -0.646 . . . . 0.40000000000000002 109.257 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -108.2 34.47 3.59 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.523 -0.735 . . . . 0.90000000000000002 110.399 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.33 147.06 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 N-CA-C 108.498 -0.927 . . . . 0.41999999999999998 108.498 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -123.43 163.47 20.78 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 109.208 -0.664 . . . . 0.46999999999999997 109.208 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttt-85 -62.29 -41.57 98.61 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.344 -0.848 . . . . 3.48 110.202 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.59 -23.87 12.15 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.912 -1.117 . . . . 0.37 110.498 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.463 ' ND2' HD22 ' A' ' 42' ' ' LEU . 49.4 t-20 -98.46 -7.22 28.91 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.95 -1.094 . . . . 0.35999999999999999 109.947 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.5 t -106.23 144.47 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.302 -0.874 . . . . 0.44 109.368 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -96.74 -39.14 9.61 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.348 -0.845 . . . . 1.9299999999999999 109.001 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.5 p-80 -156.75 154.7 30.4 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.189 -0.944 . . . . 1.0700000000000001 109.787 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.649 HD23 ' HB2' ' A' ' 40' ' ' ALA . 31.2 mt -110.93 134.95 52.15 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 109.258 -0.645 . . . . 0.28000000000000003 109.258 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -112.93 126.07 55.08 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.784 -0.821 . . . . 1.71 108.784 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 14.5 mm -94.12 135.54 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.372 -0.83 . . . . 0.5 109.856 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.0 mt -130.74 118.78 21.37 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.168 -0.958 . . . . 0.51000000000000001 108.889 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -98.46 79.83 2.54 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.982 -1.073 . . . . 1.5 108.741 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 35' ' ' ALA . 44.4 p -98.02 110.76 57.17 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.608 -0.683 . . . . 0.69999999999999996 110.794 -178.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -69.03 2.62 2.97 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.611 1.541 . . . . 0.88 111.146 178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -97.27 -18.1 19.4 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.528 -0.915 . . . . 1.23 108.528 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 57.6 m -139.08 -0.3 1.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.482 -0.761 . . . . 0.42999999999999999 109.806 -179.664 -54.399 -119.932 -81.349 103.849 2.016 103.291 -62.648 -63.102 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 34' ' ' CYS . . . 85.74 -154.24 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 109.403 -0.591 . . . . 0.35999999999999999 109.403 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.9 tp -87.27 129.75 34.86 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.089 -1.007 . . . . 0.46000000000000002 109.694 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.401 HE22 ' HB3' ' A' ' 9' ' ' CYS . 84.9 mt-30 -138.03 146.28 42.85 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.709 -0.849 . . . . 0.84999999999999998 108.709 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.1 mt -123.9 133.8 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.729 -0.607 . . . . 0.28000000000000003 109.77 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.598 HG22 ' SG ' ' A' ' 11' ' ' CYS . 56.9 t -112.13 138.98 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 107.928 -1.138 . . . . 0.47999999999999998 107.928 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.649 ' HB2' HD23 ' A' ' 26' ' ' LEU . . . -137.25 154.67 50.09 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.431 -0.793 . . . . 0.28000000000000003 108.88 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -111.05 138.77 47.06 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.442 -0.786 . . . . 2.5600000000000001 110.527 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.463 HD22 ' ND2' ' A' ' 22' ' ' ASN . 55.4 mt -74.4 125.35 28.33 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.201 -1.0 . . . . 0.39000000000000001 108.74 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -64.5 -35.16 80.04 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.865 -0.522 . . . . 1.9199999999999999 109.927 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -53.33 -72.2 0.06 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 1.22 110.497 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -96.62 5.54 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.193 -0.942 . . . . 1.8500000000000001 111.621 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.2 m120 59.82 29.69 19.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.0 -1.063 . . . . 1.3500000000000001 110.06 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -78.07 175.12 10.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.314 -0.867 . . . . 3.2999999999999998 110.181 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.42 HE21 HG11 ' A' ' 39' ' ' VAL . 66.0 tt0 -112.44 112.09 23.39 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 107.738 -1.208 . . . . 0.92000000000000004 107.738 177.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.9 t -125.46 157.1 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 N-CA-C 108.413 -0.958 . . . . 0.41999999999999998 108.413 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 47.1 m -101.05 134.86 43.41 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.146 -0.971 . . . . 0.68999999999999995 108.613 179.725 -76.729 -106.41 -80.179 102.677 2.013 100.572 -72.314 -79.011 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.474 ' CG1' ' HB3' ' A' ' 40' ' ' ALA . 20.0 mm -111.58 138.21 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.571 0.7 . . . . 0.42999999999999999 110.099 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.58 122.58 83.94 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.636 -0.665 . . . . 0.97999999999999998 109.825 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -66.37 11.58 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 121.425 1.417 . . . . 0.40999999999999998 112.705 -179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -99.4 -3.63 33.36 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.064 -1.023 . . . . 2.0 110.612 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.598 HD13 ' HE1' ' A' ' 57' ' ' TRP . 91.4 mt -71.58 140.52 49.85 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.527 -1.358 . . . . 0.40000000000000002 109.366 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -65.62 -42.13 91.91 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.028 -1.045 . . . . 2.2400000000000002 112.132 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.598 ' HE1' HD13 ' A' ' 55' ' ' LEU . 53.4 p-90 -61.68 -24.16 66.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.596 -1.315 . . . . 0.57999999999999996 109.621 -178.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.418 HD11 HG22 ' A' ' 51' ' ' ILE . 69.1 mt -68.56 -45.16 82.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 C-N-CA 119.216 -0.994 . . . . 0.40999999999999998 108.506 177.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.8 -39.95 95.83 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.434 -0.906 . . . . 2.3199999999999998 108.964 -179.06 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -62.85 -39.78 95.44 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.178 -0.951 . . . . 2.23 109.06 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.472 ' CD2' HD12 ' A' ' 26' ' ' LEU . 80.5 t80 -61.27 -41.69 97.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.267 -0.896 . . . . 0.71999999999999997 109.551 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.9 mt -70.48 -31.2 68.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.398 -0.814 . . . . 0.77000000000000002 109.807 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -72.26 -37.14 69.16 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.878 -0.786 . . . . 2.46 108.878 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -78.09 -20.15 52.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.464 -0.773 . . . . 2.46 109.896 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -92.01 -21.1 20.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.054 -1.029 . . . . 1.29 109.907 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.3 mt -86.0 -46.53 10.43 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.112 -0.993 . . . . 1.8300000000000001 110.826 -179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.6 m-20 -70.19 -35.67 74.1 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.799 -1.188 . . . . 3.3700000000000001 109.982 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 N--CA 1.493 1.711 0 O-C-N 120.929 -1.107 . . . . 4.3300000000000001 109.217 179.235 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 N--CA 1.496 1.869 0 N-CA-C 108.734 -0.839 . . . . 4.37 108.734 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.401 ' HB3' HE22 ' A' ' 37' ' ' GLN . 73.4 m -87.84 148.35 43.33 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.197 -0.939 . . . . 0.63 109.125 -179.611 -63.102 -62.648 -81.349 103.291 2.016 103.849 -119.932 -54.399 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -57.31 -30.35 87.33 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 C-N-CA 120.974 1.116 . . . . 0.58 110.468 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.598 ' SG ' HG22 ' A' ' 39' ' ' VAL . 28.2 m -124.13 137.81 54.51 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.217 -0.927 . . . . 0.74 110.359 -179.922 -79.011 -72.314 -80.179 100.572 2.013 102.677 -106.41 -76.729 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.6 mtm180 -97.85 -64.01 1.08 Allowed 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 108.31 -0.996 . . . . 3.79 108.31 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -108.9 142.6 39.27 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.9 -1.125 . . . . 1.46 108.29 178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -107.86 141.64 39.15 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.296 -0.878 . . . . 0.74 109.14 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -101.73 132.96 47.16 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.392 -0.817 . . . . 2.29 109.347 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 92.0 p -106.03 -0.31 24.99 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.257 -0.646 . . . . 0.4 109.257 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.0 m80 -108.2 34.47 3.59 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.523 -0.735 . . . . 0.9 110.399 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.33 147.06 14.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 N-CA-C 108.498 -0.927 . . . . 0.42 108.498 179.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -123.43 163.47 20.78 Favored 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 109.208 -0.664 . . . . 0.47 109.208 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.4 ttt-85 -62.29 -41.57 98.61 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.344 -0.848 . . . . 3.48 110.202 -178.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.59 -23.87 12.15 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.912 -1.117 . . . . 0.37 110.498 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.463 ' ND2' HD22 ' A' ' 42' ' ' LEU . 49.4 t-20 -98.46 -7.22 28.91 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.95 -1.094 . . . . 0.36 109.947 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 15.5 t -106.23 144.47 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.302 -0.874 . . . . 0.44 109.368 -179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -96.74 -39.14 9.61 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.348 -0.845 . . . . 1.93 109.001 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.5 p-80 -156.75 154.7 30.4 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.189 -0.944 . . . . 1.07 109.787 178.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.649 HD23 ' HB2' ' A' ' 40' ' ' ALA . 31.2 mt -110.93 134.95 52.15 Favored 'General case' 0 N--CA 1.497 1.894 0 N-CA-C 109.258 -0.645 . . . . 0.28 109.258 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -112.93 126.07 55.08 Favored 'General case' 0 N--CA 1.497 1.898 0 N-CA-C 108.784 -0.821 . . . . 1.71 108.784 179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 14.5 mm -94.12 135.54 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.372 -0.83 . . . . 0.5 109.856 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 95.0 mt -130.74 118.78 21.37 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.168 -0.958 . . . . 0.51 108.889 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -98.46 79.83 2.54 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 120.982 -1.073 . . . . 1.5 108.741 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.412 ' O ' ' N ' ' A' ' 35' ' ' ALA . 44.4 p -98.02 110.76 57.17 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.608 -0.683 . . . . 0.7 110.794 -178.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -69.03 2.62 2.97 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.611 1.541 . . . . 0.88 111.146 178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -97.27 -18.1 19.4 Favored 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 108.528 -0.915 . . . . 1.23 108.528 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.592 ' O ' ' HB3' ' A' ' 35' ' ' ALA . 57.6 m -139.08 -0.3 1.87 Allowed 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.482 -0.761 . . . . 0.43 109.806 -179.664 -54.399 -119.932 -81.349 103.849 2.016 103.291 -62.648 -63.102 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 34' ' ' CYS . . . 85.74 -154.24 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 109.403 -0.591 . . . . 0.36 109.403 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 50.9 tp -87.27 129.75 34.86 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.089 -1.007 . . . . 0.46 109.694 -179.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.401 HE22 ' HB3' ' A' ' 9' ' ' CYS . 84.9 mt-30 -138.03 146.28 42.85 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.709 -0.849 . . . . 0.85 108.709 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 58.1 mt -123.9 133.8 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.729 -0.607 . . . . 0.28 109.77 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.598 HG22 ' SG ' ' A' ' 11' ' ' CYS . 56.9 t -112.13 138.98 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 107.928 -1.138 . . . . 0.48 107.928 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.649 ' HB2' HD23 ' A' ' 26' ' ' LEU . . . -137.25 154.67 50.09 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.431 -0.793 . . . . 0.28 108.88 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -111.05 138.77 47.06 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.442 -0.786 . . . . 2.56 110.527 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.463 HD22 ' ND2' ' A' ' 22' ' ' ASN . 55.4 mt -74.4 125.35 28.33 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.201 -1.0 . . . . 0.39 108.74 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -64.5 -35.16 80.04 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.865 -0.522 . . . . 1.92 109.927 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -53.33 -72.2 0.06 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.161 -0.962 . . . . 1.22 110.497 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -96.62 5.54 50.51 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.193 -0.942 . . . . 1.85 111.621 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 25.2 m120 59.82 29.69 19.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.0 -1.063 . . . . 1.35 110.06 179.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -78.07 175.12 10.41 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.314 -0.867 . . . . 3.3 110.181 179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.42 HE21 HG11 ' A' ' 39' ' ' VAL . 66.0 tt0 -112.44 112.09 23.39 Favored 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 107.738 -1.208 . . . . 0.92 107.738 177.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 54.9 t -125.46 157.1 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 N-CA-C 108.413 -0.958 . . . . 0.42 108.413 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 47.1 m -101.05 134.86 43.41 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.146 -0.971 . . . . 0.69 108.613 179.725 -76.729 -106.41 -80.179 102.677 2.013 100.572 -72.314 -79.011 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.474 ' CG1' ' HB3' ' A' ' 40' ' ' ALA . 20.0 mm -111.58 138.21 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.571 0.7 . . . . 0.43 110.099 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -67.58 122.58 83.94 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.636 -0.665 . . . . 0.98 109.825 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -66.37 11.58 0.16 Allowed 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 121.425 1.417 . . . . 0.41 112.705 -179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -99.4 -3.63 33.36 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.064 -1.023 . . . . 2.0 110.612 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.598 HD13 ' HE1' ' A' ' 57' ' ' TRP . 91.4 mt -71.58 140.52 49.85 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.527 -1.358 . . . . 0.4 109.366 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 22.8 mttp -65.62 -42.13 91.91 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.028 -1.045 . . . . 2.24 112.132 -178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.598 ' HE1' HD13 ' A' ' 55' ' ' LEU . 53.4 p-90 -61.68 -24.16 66.57 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.596 -1.315 . . . . 0.58 109.621 -178.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.418 HD11 HG22 ' A' ' 51' ' ' ILE . 69.1 mt -68.56 -45.16 82.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 C-N-CA 119.216 -0.994 . . . . 0.41 108.506 177.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -62.8 -39.95 95.83 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.434 -0.906 . . . . 2.32 108.964 -179.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -62.85 -39.78 95.44 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.178 -0.951 . . . . 2.23 109.06 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.472 ' CD2' HD12 ' A' ' 26' ' ' LEU . 80.5 t80 -61.27 -41.69 97.36 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.267 -0.896 . . . . 0.72 109.551 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 81.9 mt -70.48 -31.2 68.22 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.398 -0.814 . . . . 0.77 109.807 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -72.26 -37.14 69.16 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 108.878 -0.786 . . . . 2.46 108.878 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -78.09 -20.15 52.82 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.464 -0.773 . . . . 2.46 109.896 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -92.01 -21.1 20.7 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.054 -1.029 . . . . 1.29 109.907 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 56.3 mt -86.0 -46.53 10.43 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.112 -0.993 . . . . 1.83 110.826 -179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.6 m-20 -70.19 -35.67 74.1 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.799 -1.188 . . . . 3.37 109.982 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mttt . . . . . 0 N--CA 1.493 1.711 0 O-C-N 120.929 -1.107 . . . . 4.33 109.217 179.235 . . . . . . . . 0 0 . 1 stop_ save_