data_1edx_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 1edx _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' ' ' MET . . . . . . . . . . . . . 42.6 ttm . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 118.374 -0.822 . . . . 0.73999999999999999 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 65.59 -67.64 0.13 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.19 1.396 . . . . 0.68000000000000005 109.148 -166.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -99.06 -141.41 12.23 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 106.999 -2.44 . . . . 0.62 106.999 158.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.1 t -175.49 -55.68 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.709 1.204 . . . . 0.62 110.35 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 62.61 -27.9 0.07 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.492 1.917 . . . . 0.70999999999999996 115.718 -170.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 9.03 -79.65 0.0 OUTLIER Glycine 0 CA--C 1.537 1.468 0 C-N-CA 129.193 3.282 . . . . 0.62 116.925 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -60.19 -34.35 94.2 Favored 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 122.817 2.344 . . . . 0.53000000000000003 115.054 -175.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -179.92 7.29 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 114.333 1.234 . . . . 0.68000000000000005 114.333 -156.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.5 t80 34.33 69.88 0.14 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.718 2.407 . . . . 0.62 113.889 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 50.01 44.28 25.59 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.277 1.031 . . . . 0.62 112.355 163.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t 69.65 112.46 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 125.616 1.566 . . . . 0.62 108.462 -168.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.54 8.3 0.75 Allowed 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.96 3.107 . . . . 0.53000000000000003 115.677 -164.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -58.53 -43.57 89.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.293 1.037 . . . . 0.62 109.345 156.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 34.6 t -52.14 -38.43 57.51 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.764 1.626 . . . . 0.62 113.47 -166.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -91.77 -90.28 0.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.403 0.681 . . . . 0.68000000000000005 112.439 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.2 11.91 4.86 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 114.971 1.471 . . . . 0.62 114.971 -155.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 p -56.18 -63.99 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 118.727 0.694 . . . . 0.62 109.303 174.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -47.2 -41.62 15.89 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.185 0.898 . . . . 0.62 111.848 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.9 t -68.6 -64.57 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 123.075 0.55 . . . . 0.62 110.554 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.2 t -88.23 -37.06 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 O-C-N 122.127 -0.358 . . . . 0.62 111.574 -165.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mmm-85 -126.22 58.3 1.37 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.67 1.188 . . . . 0.76000000000000001 107.911 -173.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m -55.32 -44.28 99.55 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 116.917 2.192 . . . . 0.62 116.917 -169.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -39.41 -54.07 1.97 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.144 3.229 . . . . 0.53000000000000003 118.102 -164.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -111.81 140.99 45.99 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 130.218 3.407 . . . . 0.62 108.832 1.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.59 -50.95 4.95 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.342 1.057 . . . . 0.70999999999999996 109.412 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -49.87 -47.67 79.59 Favored Pre-proline 0 N--CA 1.452 -0.336 0 C-N-CA 124.695 1.198 . . . . 0.62 114.068 -168.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -50.2 -34.87 41.13 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.013 2.476 . . . . 0.53000000000000003 114.331 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.8 -24.08 62.49 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.374 0.534 . . . . 0.68000000000000005 112.118 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -109.8 -44.55 3.8 Favored 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.363 0.665 . . . . 0.62 112.318 -167.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.62 83.71 0.89 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.5 0.667 . . . . 0.62 112.709 -169.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -70.74 67.87 0.39 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.955 0.902 . . . . 0.62 110.28 170.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.03 -95.89 0.47 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.106 0.962 . . . . 0.62 109.878 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.471 ' N ' ' CD ' ' A' ' 34' ' ' PRO . 13.9 pt-20 -141.54 24.16 0.06 OUTLIER Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.086 1.355 . . . . 0.70999999999999996 113.28 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 33' ' ' GLU . 98.1 Cg_endo -66.39 -34.49 34.5 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 122.028 1.819 . . . . 0.53000000000000003 111.934 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -43.13 61.2 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.905 0.882 . . . . 0.62 110.923 -175.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.42 82.81 5.5 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.70999999999999996 109.291 -172.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 t80 73.87 -28.74 0.19 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.754 1.622 . . . . 0.62 112.914 168.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t -52.91 -50.94 62.93 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.156 1.382 . . . . 0.62 111.261 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 10.1 mmt 70.28 -58.63 0.54 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 126.428 1.891 . . . . 0.73999999999999999 110.696 -174.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.25 1.104 0 N-CA-C 105.765 -1.939 . . . . 0.52000000000000002 105.765 159.055 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.6 ttm . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 118.374 -0.822 . . . . 0.74 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 65.59 -67.64 0.13 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.19 1.396 . . . . 0.68 109.148 -166.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -99.06 -141.41 12.23 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 106.999 -2.44 . . . . 0.62 106.999 158.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.1 t -175.49 -55.68 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.709 1.204 . . . . 0.62 110.35 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 62.61 -27.9 0.07 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.492 1.917 . . . . 0.71 115.718 -170.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 9.03 -79.65 0.0 OUTLIER Glycine 0 CA--C 1.537 1.468 0 C-N-CA 129.193 3.282 . . . . 0.62 116.925 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -60.19 -34.35 94.2 Favored 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 122.817 2.344 . . . . 0.53 115.054 -175.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -179.92 7.29 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 114.333 1.234 . . . . 0.68 114.333 -156.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.5 t80 34.33 69.88 0.14 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.718 2.407 . . . . 0.62 113.889 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 50.01 44.28 25.59 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.277 1.031 . . . . 0.62 112.355 163.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t 69.65 112.46 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 125.616 1.566 . . . . 0.62 108.462 -168.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.54 8.3 0.75 Allowed 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.96 3.107 . . . . 0.53 115.677 -164.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -58.53 -43.57 89.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.293 1.037 . . . . 0.62 109.345 156.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 34.6 t -52.14 -38.43 57.51 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.764 1.626 . . . . 0.62 113.47 -166.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -91.77 -90.28 0.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.403 0.681 . . . . 0.68 112.439 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.2 11.91 4.86 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 114.971 1.471 . . . . 0.62 114.971 -155.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 p -56.18 -63.99 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 118.727 0.694 . . . . 0.62 109.303 174.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -47.2 -41.62 15.89 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.185 0.898 . . . . 0.62 111.848 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.9 t -68.6 -64.57 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 123.075 0.55 . . . . 0.62 110.554 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.2 t -88.23 -37.06 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 O-C-N 122.127 -0.358 . . . . 0.62 111.574 -165.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mmm-85 -126.22 58.3 1.37 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.67 1.188 . . . . 0.76 107.911 -173.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m -55.32 -44.28 99.55 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 116.917 2.192 . . . . 0.62 116.917 -169.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -39.41 -54.07 1.97 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.144 3.229 . . . . 0.53 118.102 -164.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -111.81 140.99 45.99 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 130.218 3.407 . . . . 0.62 108.832 1.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.59 -50.95 4.95 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.342 1.057 . . . . 0.71 109.412 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -49.87 -47.67 79.59 Favored Pre-proline 0 N--CA 1.452 -0.336 0 C-N-CA 124.695 1.198 . . . . 0.62 114.068 -168.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -50.2 -34.87 41.13 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.013 2.476 . . . . 0.53 114.331 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.8 -24.08 62.49 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.374 0.534 . . . . 0.68 112.118 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -109.8 -44.55 3.8 Favored 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.363 0.665 . . . . 0.62 112.318 -167.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.62 83.71 0.89 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.5 0.667 . . . . 0.62 112.709 -169.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -70.74 67.87 0.39 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.955 0.902 . . . . 0.62 110.28 170.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.03 -95.89 0.47 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.106 0.962 . . . . 0.62 109.878 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.471 ' N ' ' CD ' ' A' ' 34' ' ' PRO . 13.9 pt-20 -141.54 24.16 0.06 OUTLIER Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.086 1.355 . . . . 0.71 113.28 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 33' ' ' GLU . 98.1 Cg_endo -66.39 -34.49 34.5 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 122.028 1.819 . . . . 0.53 111.934 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -43.13 61.2 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.905 0.882 . . . . 0.62 110.923 -175.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.42 82.81 5.5 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.71 109.291 -172.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 t80 73.87 -28.74 0.19 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.754 1.622 . . . . 0.62 112.914 168.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t -52.91 -50.94 62.93 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.156 1.382 . . . . 0.62 111.261 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 10.1 mmt 70.28 -58.63 0.54 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 126.428 1.891 . . . . 0.74 110.696 -174.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.25 1.104 0 N-CA-C 105.765 -1.939 . . . . 0.52 105.765 159.055 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.6 ttm . . . . . 0 N--CA 1.471 0.582 0 CA-C-O 118.374 -0.822 . . . . 0.74 110.292 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 65.59 -67.64 0.13 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.19 1.396 . . . . 0.68 109.148 -166.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -99.06 -141.41 12.23 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 106.999 -2.44 . . . . 0.62 106.999 158.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.1 t -175.49 -55.68 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.709 1.204 . . . . 0.62 110.35 166.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 62.61 -27.9 0.07 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.492 1.917 . . . . 0.71 115.718 -170.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 9.03 -79.65 0.0 OUTLIER Glycine 0 CA--C 1.537 1.468 0 C-N-CA 129.193 3.282 . . . . 0.62 116.925 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -60.19 -34.35 94.2 Favored 'Trans proline' 0 CA--C 1.536 0.612 0 C-N-CA 122.817 2.344 . . . . 0.53 115.054 -175.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.37 -179.92 7.29 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 114.333 1.234 . . . . 0.68 114.333 -156.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.5 t80 34.33 69.88 0.14 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 127.718 2.407 . . . . 0.62 113.889 170.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 50.01 44.28 25.59 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.277 1.031 . . . . 0.62 112.355 163.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t 69.65 112.46 0.03 OUTLIER Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 125.616 1.566 . . . . 0.62 108.462 -168.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -69.54 8.3 0.75 Allowed 'Trans proline' 0 CA--C 1.538 0.681 0 C-N-CA 123.96 3.107 . . . . 0.53 115.677 -164.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -58.53 -43.57 89.25 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.293 1.037 . . . . 0.62 109.345 156.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 34.6 t -52.14 -38.43 57.51 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.764 1.626 . . . . 0.62 113.47 -166.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -91.77 -90.28 0.17 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.403 0.681 . . . . 0.68 112.439 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.2 11.91 4.86 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 114.971 1.471 . . . . 0.62 114.971 -155.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.9 p -56.18 -63.99 1.01 Allowed 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 118.727 0.694 . . . . 0.62 109.303 174.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -47.2 -41.62 15.89 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 124.185 0.898 . . . . 0.62 111.848 178.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 56.9 t -68.6 -64.57 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 C-N-CA 123.075 0.55 . . . . 0.62 110.554 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.2 t -88.23 -37.06 10.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 O-C-N 122.127 -0.358 . . . . 0.62 111.574 -165.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 32.6 mmm-85 -126.22 58.3 1.37 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.67 1.188 . . . . 0.76 107.911 -173.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m -55.32 -44.28 99.55 Favored Pre-proline 0 CA--C 1.538 0.503 0 N-CA-C 116.917 2.192 . . . . 0.62 116.917 -169.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -39.41 -54.07 1.97 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 124.144 3.229 . . . . 0.53 118.102 -164.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 3.5 p90 -111.81 140.99 45.99 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 130.218 3.407 . . . . 0.62 108.832 1.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.59 -50.95 4.95 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.342 1.057 . . . . 0.71 109.412 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -49.87 -47.67 79.59 Favored Pre-proline 0 N--CA 1.452 -0.336 0 C-N-CA 124.695 1.198 . . . . 0.62 114.068 -168.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_exo -50.2 -34.87 41.13 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 123.013 2.476 . . . . 0.53 114.331 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -70.8 -24.08 62.49 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.374 0.534 . . . . 0.68 112.118 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -109.8 -44.55 3.8 Favored 'General case' 0 C--N 1.338 0.087 0 C-N-CA 123.363 0.665 . . . . 0.62 112.318 -167.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -157.62 83.71 0.89 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.5 0.667 . . . . 0.62 112.709 -169.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.8 mt -70.74 67.87 0.39 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.955 0.902 . . . . 0.62 110.28 170.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -123.03 -95.89 0.47 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.106 0.962 . . . . 0.62 109.878 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.471 ' N ' ' CD ' ' A' ' 34' ' ' PRO . 13.9 pt-20 -141.54 24.16 0.06 OUTLIER Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.086 1.355 . . . . 0.71 113.28 -179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 33' ' ' GLU . 98.1 Cg_endo -66.39 -34.49 34.5 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 122.028 1.819 . . . . 0.53 111.934 -170.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -43.13 61.2 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.905 0.882 . . . . 0.62 110.923 -175.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -79.42 82.81 5.5 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.291 -0.633 . . . . 0.71 109.291 -172.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.5 t80 73.87 -28.74 0.19 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.754 1.622 . . . . 0.62 112.914 168.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.3 t -52.91 -50.94 62.93 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.156 1.382 . . . . 0.62 111.261 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 10.1 mmt 70.28 -58.63 0.54 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 126.428 1.891 . . . . 0.74 110.696 -174.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.25 1.104 0 N-CA-C 105.765 -1.939 . . . . 0.52 105.765 159.055 . . . . . . . . 0 0 . 1 stop_ save_