data_1go9_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 1go9 _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' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -82.59 136.82 34.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 153.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -151.69 168.41 11.23 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 104.84 -2.281 . . . . 0.0 104.84 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -58.51 145.32 95.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 106.327 -2.221 . . . . 0.0 106.327 160.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.24 72.91 5.21 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.899 2.4 . . . . 0.0 109.984 -171.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -73.35 -44.13 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -160.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.3 m -61.7 -36.21 80.24 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 123.482 0.713 . . . . 0.0 112.06 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.49 -45.03 63.58 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.672 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.28 -46.77 87.29 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.46 0.647 . . . . 0.0 110.059 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.85 -40.3 92.37 Favored 'General case' 0 N--CA 1.455 -0.225 0 O-C-N 121.939 -0.476 . . . . 0.0 109.821 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.7 m -57.83 -38.05 74.93 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 119.223 -0.418 . . . . 0.0 110.534 172.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' DPN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.6 -62.92 1.19 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.169 0.509 . . . . 0.0 110.443 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 pp -78.51 13.07 1.71 Allowed 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -172.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 124.697 1.199 . . . . 0.0 108.288 156.758 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -65.58 -9.66 28.61 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 120.922 -1.111 . . . . 0.0 112.887 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -96.34 -67.34 0.85 Allowed 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -81.9 -10.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 119.827 -1.796 . . . . 0.0 112.463 -159.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.7 tt -115.52 -48.11 2.8 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.554 1.142 . . . . 0.0 109.744 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -74.38 -44.85 50.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 119.823 1.192 . . . . 0.0 109.65 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 6.0 ttm -68.8 -49.17 60.78 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.98 -48.03 79.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.625 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttt85 -64.67 -36.34 83.97 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.692 -0.63 . . . . 0.0 110.727 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.09 72.22 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.166 0.987 . . . . 0.0 110.697 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.73 -38.58 85.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.143 0.977 . . . . 0.0 108.983 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -65.3 -47.93 74.9 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 121.976 -0.452 . . . . 0.0 110.024 173.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.17 -28.04 69.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 119.771 -0.772 . . . . 0.0 109.272 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.2 -50.35 14.76 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -63.88 -38.1 89.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.985 -0.447 . . . . 0.0 109.904 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -88.93 -6.64 57.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.246 1.418 . . . . 0.0 111.208 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.26 -61.29 1.84 Allowed 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 166.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -71.95 -45.58 60.57 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.274 1.429 . . . . 0.0 108.863 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -60.21 -51.88 67.69 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 175.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -61.97 -35.54 78.79 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.666 -177.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -77.17 -28.7 54.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 126.427 1.891 . . . . 0.0 108.402 -176.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.2 tttt -69.34 -49.05 59.26 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 119.689 1.131 . . . . 0.0 109.709 173.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.209 0.528 . . . . 0.0 110.421 177.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 21.4 ttt -64.59 -42.23 95.72 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.022 0.929 . . . . 0.0 108.983 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -61.01 -30.68 70.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.826 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -47.05 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.063 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.2 tt -85.71 37.03 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.417 0.627 . . . . 0.0 110.045 -177.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.141 0 O-C-N 121.13 -0.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 1.9 pm0 -82.59 136.82 34.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 153.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -151.69 168.41 11.23 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 104.84 -2.281 . . . . 0.0 104.84 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -58.51 145.32 95.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 106.327 -2.221 . . . . 0.0 106.327 160.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.24 72.91 5.21 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.899 2.4 . . . . 0.0 109.984 -171.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -73.35 -44.13 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -160.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.3 m -61.7 -36.21 80.24 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 123.482 0.713 . . . . 0.0 112.06 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.49 -45.03 63.58 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.672 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.28 -46.77 87.29 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.46 0.647 . . . . 0.0 110.059 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.85 -40.3 92.37 Favored 'General case' 0 N--CA 1.455 -0.225 0 O-C-N 121.939 -0.476 . . . . 0.0 109.821 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.7 m -57.83 -38.05 74.93 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 119.223 -0.418 . . . . 0.0 110.534 172.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' DPN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.6 -62.92 1.19 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.169 0.509 . . . . 0.0 110.443 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 pp -78.51 13.07 1.71 Allowed 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -172.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 124.697 1.199 . . . . 0.0 108.288 156.758 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -65.58 -9.66 28.61 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 120.922 -1.111 . . . . 0.0 112.887 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -96.34 -67.34 0.85 Allowed 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -81.9 -10.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 119.827 -1.796 . . . . 0.0 112.463 -159.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.7 tt -115.52 -48.11 2.8 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.554 1.142 . . . . 0.0 109.744 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -74.38 -44.85 50.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 119.823 1.192 . . . . 0.0 109.65 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 6.0 ttm -68.8 -49.17 60.78 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.98 -48.03 79.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.625 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttt85 -64.67 -36.34 83.97 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.692 -0.63 . . . . 0.0 110.727 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.09 72.22 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.166 0.987 . . . . 0.0 110.697 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.73 -38.58 85.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.143 0.977 . . . . 0.0 108.983 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -65.3 -47.93 74.9 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 121.976 -0.452 . . . . 0.0 110.024 173.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.17 -28.04 69.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 119.771 -0.772 . . . . 0.0 109.272 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.2 -50.35 14.76 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -63.88 -38.1 89.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.985 -0.447 . . . . 0.0 109.904 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -88.93 -6.64 57.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.246 1.418 . . . . 0.0 111.208 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.26 -61.29 1.84 Allowed 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 166.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -71.95 -45.58 60.57 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.274 1.429 . . . . 0.0 108.863 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -60.21 -51.88 67.69 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 175.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -61.97 -35.54 78.79 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.666 -177.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -77.17 -28.7 54.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 126.427 1.891 . . . . 0.0 108.402 -176.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.2 tttt -69.34 -49.05 59.26 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 119.689 1.131 . . . . 0.0 109.709 173.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.209 0.528 . . . . 0.0 110.421 177.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 21.4 ttt -64.59 -42.23 95.72 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.022 0.929 . . . . 0.0 108.983 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -61.01 -30.68 70.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.826 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -47.05 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.063 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.2 tt -85.71 37.03 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.417 0.627 . . . . 0.0 110.045 -177.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.141 0 O-C-N 121.13 -0.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.2 m . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 108.331 -0.989 . . . . 0.0 108.331 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 2' ' ' GLU . 1.9 pm0 -82.59 136.82 34.72 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 153.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -151.69 168.41 11.23 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 104.84 -2.281 . . . . 0.0 104.84 -169.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -58.51 145.32 95.12 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 N-CA-C 106.327 -2.221 . . . . 0.0 106.327 160.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.24 72.91 5.21 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.899 2.4 . . . . 0.0 109.984 -171.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -73.35 -44.13 55.31 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.625 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 -160.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.3 m -61.7 -36.21 80.24 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 123.482 0.713 . . . . 0.0 112.06 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 25.8 tp -71.49 -45.03 63.58 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.672 -178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -62.28 -46.77 87.29 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.46 0.647 . . . . 0.0 110.059 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.85 -40.3 92.37 Favored 'General case' 0 N--CA 1.455 -0.225 0 O-C-N 121.939 -0.476 . . . . 0.0 109.821 176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.7 m -57.83 -38.05 74.93 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-O 119.223 -0.418 . . . . 0.0 110.534 172.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' DPN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -69.6 -62.92 1.19 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.169 0.509 . . . . 0.0 110.443 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 pp -78.51 13.07 1.71 Allowed 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -172.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' AIB . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.407 0 C-N-CA 124.697 1.199 . . . . 0.0 108.288 156.758 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -65.58 -9.66 28.61 Favored 'General case' 0 C--O 1.223 -0.291 0 O-C-N 120.922 -1.111 . . . . 0.0 112.887 173.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -96.34 -67.34 0.85 Allowed 'General case' 0 N--CA 1.439 -1.012 0 N-CA-C 106.324 -1.732 . . . . 0.0 106.324 171.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -81.9 -10.96 12.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 119.827 -1.796 . . . . 0.0 112.463 -159.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.7 tt -115.52 -48.11 2.8 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 124.554 1.142 . . . . 0.0 109.744 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -74.38 -44.85 50.38 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 119.823 1.192 . . . . 0.0 109.65 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 6.0 ttm -68.8 -49.17 60.78 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -56.98 -48.03 79.39 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.625 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 36.8 ttt85 -64.67 -36.34 83.97 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.692 -0.63 . . . . 0.0 110.727 -176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.01 -46.09 72.22 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.166 0.987 . . . . 0.0 110.697 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -60.73 -38.58 85.63 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.143 0.977 . . . . 0.0 108.983 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -65.3 -47.93 74.9 Favored 'General case' 0 N--CA 1.443 -0.799 0 O-C-N 121.976 -0.452 . . . . 0.0 110.024 173.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.17 -28.04 69.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 119.771 -0.772 . . . . 0.0 109.272 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.2 -50.35 14.76 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 108.447 -0.945 . . . . 0.0 108.447 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -63.88 -38.1 89.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 O-C-N 121.985 -0.447 . . . . 0.0 109.904 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -88.93 -6.64 57.13 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.246 1.418 . . . . 0.0 111.208 -174.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.26 -61.29 1.84 Allowed 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 107.441 -1.318 . . . . 0.0 107.441 166.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -71.95 -45.58 60.57 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 125.274 1.429 . . . . 0.0 108.863 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 11.2 t -60.21 -51.88 67.69 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 175.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -61.97 -35.54 78.79 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.666 -177.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -77.17 -28.7 54.16 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 126.427 1.891 . . . . 0.0 108.402 -176.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.2 tttt -69.34 -49.05 59.26 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-N 119.689 1.131 . . . . 0.0 109.709 173.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.49 -47.54 85.11 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.209 0.528 . . . . 0.0 110.421 177.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' MET . . . . . . . . . . . . . 21.4 ttt -64.59 -42.23 95.72 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.022 0.929 . . . . 0.0 108.983 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -61.01 -30.68 70.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.826 177.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -47.05 54.96 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.096 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.063 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.2 tt -85.71 37.03 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 CA-C-O 121.417 0.627 . . . . 0.0 110.045 -177.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.141 0 O-C-N 121.13 -0.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_