data_1bl1_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 1bl1 _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 . . . . . . . . . . . . . 88.2 p . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 118.779 -0.629 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.1 -39.41 86.04 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.24 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 169.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.37 -36.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 117.803 -1.094 . . . . 0.0 113.909 175.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -58.13 -53.6 56.41 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -62.12 -33.72 75.01 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.7 mt -65.84 -41.49 91.67 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.4 p -67.38 -30.53 70.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 115.672 1.73 . . . . 0.0 115.672 170.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -65.57 -56.18 13.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 120.218 1.372 . . . . 0.0 113.123 170.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -108.26 99.41 8.83 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.3 p -92.48 70.89 5.07 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.806 0.812 . . . . 0.0 110.531 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.6 mmp_? -97.93 -41.49 7.98 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.009 0.924 . . . . 0.0 112.772 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -48.67 40.3 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 171.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -64.34 -32.47 74.09 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.54 -42.35 59.0 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 175.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.7 m -67.42 -40.39 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -71.58 -21.15 61.91 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 116.474 2.027 . . . . 0.0 116.474 169.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.17 -42.05 89.89 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 120.509 1.504 . . . . 0.0 114.34 160.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -85.02 89.39 7.6 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 170.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.287 4.5 pp -68.83 -34.12 74.96 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -59.24 -50.12 71.18 Favored Glycine 0 CA--C 1.55 2.267 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 168.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 64.8 mtt -91.85 69.25 5.51 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.012 0.906 . . . . 0.0 111.459 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.297 10.4 tp -166.47 -60.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 C-N-CA 124.534 1.133 . . . . 0.0 108.615 175.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -67.93 -29.19 68.2 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 37.4 m -66.73 -40.71 88.47 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 119.99 1.268 . . . . 0.0 113.243 168.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.9 t -61.56 -54.11 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 C-N-CA 124.277 1.031 . . . . 0.0 112.263 172.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -57.67 -45.78 92.93 Favored Glycine 0 CA--C 1.55 2.26 0 N-CA-C 117.796 1.879 . . . . 0.0 117.796 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.35 -38.94 78.24 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 171.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 t -58.87 -46.25 88.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 171.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.1 m -88.4 89.8 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-N 119.104 0.865 . . . . 0.0 109.67 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 179.031 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 118.779 -0.629 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.1 -39.41 86.04 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.24 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 169.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.37 -36.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 117.803 -1.094 . . . . 0.0 113.909 175.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -58.13 -53.6 56.41 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -62.12 -33.72 75.01 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.7 mt -65.84 -41.49 91.67 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.4 p -67.38 -30.53 70.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 115.672 1.73 . . . . 0.0 115.672 170.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -65.57 -56.18 13.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 120.218 1.372 . . . . 0.0 113.123 170.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -108.26 99.41 8.83 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.3 p -92.48 70.89 5.07 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.806 0.812 . . . . 0.0 110.531 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.6 mmp_? -97.93 -41.49 7.98 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.009 0.924 . . . . 0.0 112.772 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -48.67 40.3 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 171.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -64.34 -32.47 74.09 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.54 -42.35 59.0 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 175.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.7 m -67.42 -40.39 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -71.58 -21.15 61.91 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 116.474 2.027 . . . . 0.0 116.474 169.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.17 -42.05 89.89 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 120.509 1.504 . . . . 0.0 114.34 160.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -85.02 89.39 7.6 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 170.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.287 4.5 pp -68.83 -34.12 74.96 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -59.24 -50.12 71.18 Favored Glycine 0 CA--C 1.55 2.267 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 168.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 64.8 mtt -91.85 69.25 5.51 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.012 0.906 . . . . 0.0 111.459 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.297 10.4 tp -166.47 -60.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 C-N-CA 124.534 1.133 . . . . 0.0 108.615 175.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -67.93 -29.19 68.2 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 37.4 m -66.73 -40.71 88.47 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 119.99 1.268 . . . . 0.0 113.243 168.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.9 t -61.56 -54.11 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 C-N-CA 124.277 1.031 . . . . 0.0 112.263 172.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -57.67 -45.78 92.93 Favored Glycine 0 CA--C 1.55 2.26 0 N-CA-C 117.796 1.879 . . . . 0.0 117.796 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.35 -38.94 78.24 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 171.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 t -58.87 -46.25 88.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 171.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.1 m -88.4 89.8 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-N 119.104 0.865 . . . . 0.0 109.67 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 179.031 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 88.2 p . . . . . 0 N--CA 1.481 1.08 0 CA-C-O 118.779 -0.629 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.1 -39.41 86.04 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 117.095 2.258 . . . . 0.0 117.095 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.85 93.24 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 169.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 57.4 t -66.37 -36.87 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 CA-C-O 117.803 -1.094 . . . . 0.0 113.909 175.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -58.13 -53.6 56.41 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 115.623 1.712 . . . . 0.0 115.623 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -62.12 -33.72 75.01 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 116.855 2.168 . . . . 0.0 116.855 171.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 75.7 mt -65.84 -41.49 91.67 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.4 p -67.38 -30.53 70.34 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 115.672 1.73 . . . . 0.0 115.672 170.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -65.57 -56.18 13.69 Favored 'General case' 0 N--CA 1.494 1.752 0 CA-C-N 120.218 1.372 . . . . 0.0 113.123 170.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -108.26 99.41 8.83 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 175.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 71.3 p -92.48 70.89 5.07 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.806 0.812 . . . . 0.0 110.531 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.6 mmp_? -97.93 -41.49 7.98 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.009 0.924 . . . . 0.0 112.772 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -48.67 40.3 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 171.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.3 ppt_? -64.34 -32.47 74.09 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 116.603 2.075 . . . . 0.0 116.603 173.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -74.54 -42.35 59.0 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 175.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.7 m -67.42 -40.39 84.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 174.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -71.58 -21.15 61.91 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 116.474 2.027 . . . . 0.0 116.474 169.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -59.17 -42.05 89.89 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 120.509 1.504 . . . . 0.0 114.34 160.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -85.02 89.39 7.6 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 170.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . 0.287 4.5 pp -68.83 -34.12 74.96 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 116.533 2.049 . . . . 0.0 116.533 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -59.24 -50.12 71.18 Favored Glycine 0 CA--C 1.55 2.267 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 168.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 64.8 mtt -91.85 69.25 5.51 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.012 0.906 . . . . 0.0 111.459 178.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . 0.297 10.4 tp -166.47 -60.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 C-N-CA 124.534 1.133 . . . . 0.0 108.615 175.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -67.93 -29.19 68.2 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 116.375 1.991 . . . . 0.0 116.375 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 37.4 m -66.73 -40.71 88.47 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 119.99 1.268 . . . . 0.0 113.243 168.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 45.9 t -61.56 -54.11 39.28 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 C-N-CA 124.277 1.031 . . . . 0.0 112.263 172.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -57.67 -45.78 92.93 Favored Glycine 0 CA--C 1.55 2.26 0 N-CA-C 117.796 1.879 . . . . 0.0 117.796 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.35 -38.94 78.24 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 115.932 1.827 . . . . 0.0 115.932 171.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.2 t -58.87 -46.25 88.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 171.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.1 m -88.4 89.8 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 CA-C-N 119.104 0.865 . . . . 0.0 109.67 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 90.0 m . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 179.031 . . . . . . . . 0 0 . 1 stop_ save_