data_1nyf_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 1nyf _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 ' 84' ' ' VAL . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.473 -0.565 . . . . 14.130000000000001 109.473 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.96 73.66 1.41 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.285 -0.884 . . . . 10.640000000000001 109.421 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -90.57 121.13 32.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 4.2999999999999998 109.515 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -117.85 162.14 18.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 1.3200000000000001 109.425 179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.456 ' O ' ' HA ' ' A' ' 138' ' ' VAL . 1.5 t -127.37 152.46 35.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 1.1799999999999999 109.468 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 137' ' ' TYR . . . -82.64 112.91 19.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.289 -0.882 . . . . 1.1299999999999999 109.431 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.553 ' O ' ' CD1' ' A' ' 91' ' ' TYR . 1.0 OUTLIER -71.17 -14.19 62.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 1.5800000000000001 109.524 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.553 ' CD1' ' O ' ' A' ' 90' ' ' LEU . 7.3 m-85 -150.89 160.14 44.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.216 -0.927 . . . . 2.8399999999999999 109.463 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.07 153.14 38.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.306 -0.871 . . . . 2.5499999999999998 109.429 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -139.57 138.21 36.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.182 -0.949 . . . . 1.55 109.443 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 95' ' ' ALA . 46.6 mt-10 -109.29 95.97 5.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.247 -0.908 . . . . 3.3599999999999999 109.43 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.418 ' HB1' ' HB3' ' A' ' 102' ' ' SER . . . -45.15 123.35 3.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.25 -0.906 . . . . 7.4500000000000002 109.457 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -3.33 21.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.257 -0.902 . . . . 13.16 109.422 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.76 169.95 15.01 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.201 -0.937 . . . . 9.5 109.232 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -84.09 10.61 9.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.215 -0.928 . . . . 12.039999999999999 109.49 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -111.71 -21.46 11.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.266 -0.896 . . . . 4.8700000000000001 109.516 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -96.88 171.0 8.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 3.1800000000000002 109.569 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.495 HD12 ' N ' ' A' ' 131' ' ' GLY . 1.1 mt -115.73 169.84 8.91 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.23 -0.919 . . . . 1.73 109.509 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.418 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 75.2 p -127.08 140.22 52.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 1.51 109.488 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.416 ' CD2' ' CZ ' ' A' ' 109' ' ' PHE . 18.4 p90 -165.19 -169.19 1.57 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.22 109.553 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.5 m80 -129.09 155.3 45.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.265 -0.897 . . . . 1.97 109.404 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.416 ' HB2' ' HA ' ' A' ' 91' ' ' TYR . 7.9 tttm -53.18 122.23 9.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 2.8300000000000001 109.509 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 119.67 -6.98 12.35 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.648 -1.381 . . . . 1.8200000000000001 109.648 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.19 155.25 26.26 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -1.181 . . . . 1.5 109.489 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -100.91 156.95 17.09 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.248 -0.907 . . . . 2.46 109.415 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.416 ' CZ ' ' CD2' ' A' ' 103' ' ' PHE . 64.8 m-85 -149.92 147.05 27.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 1.1799999999999999 109.454 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -106.69 99.43 9.01 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 1.1200000000000001 109.516 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.459 HD12 ' HB3' ' A' ' 122' ' ' ALA . 41.8 mm -67.29 118.85 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 1.0900000000000001 109.398 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.8 mt -106.41 -32.15 8.25 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 2.3300000000000001 109.408 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -142.28 101.37 3.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.258 -0.901 . . . . 3.1099999999999999 109.613 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . 0.565 ' HB3' ' CD2' ' A' ' 120' ' ' TRP . 0.0 OUTLIER -95.97 -72.58 0.63 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.295 -0.878 . . . . 3.2999999999999998 109.292 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . 0.537 ' O ' ' CG ' ' A' ' 116' ' ' GLU . 14.3 t 55.7 42.3 29.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -0.84 . . . . 16.699999999999999 109.733 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.537 ' CG ' ' O ' ' A' ' 115' ' ' SER . 12.3 pt-20 40.39 -162.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.56 -0.712 . . . . 40.0 109.833 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 118' ' ' ASP . . . 111.11 -86.26 0.42 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.52 -1.432 . . . . 31.109999999999999 109.52 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' A' ' 117' ' ' GLY . 1.1 m-20 170.59 -31.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.307 -1.113 . . . . 7.4900000000000002 109.385 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -119.04 106.86 12.83 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 4.0199999999999996 109.401 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.565 ' CD2' ' HB3' ' A' ' 114' ' ' SER . 24.2 m0 -90.31 158.81 16.97 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 2.23 109.645 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.576 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 3.5 mt-10 -100.49 107.0 18.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 1.6100000000000001 108.813 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.459 ' HB3' HD12 ' A' ' 111' ' ' ILE . . . -117.0 149.76 39.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.053 -1.03 . . . . 2.8399999999999999 109.941 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . 0.478 ' CG ' ' HB ' ' A' ' 130' ' ' THR . 0.3 OUTLIER -104.26 126.71 51.6 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.345 -0.847 . . . . 1.99 109.222 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.62 122.0 18.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.226 -0.921 . . . . 2.77 109.553 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 12.9 mt -77.92 -17.55 57.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.25 -0.906 . . . . 4.6600000000000001 109.385 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 56.3 m -83.61 -56.68 3.59 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.317 -0.864 . . . . 8.0999999999999996 109.507 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.24 -41.17 17.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.2 -0.937 . . . . 11.83 109.392 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.65 -14.56 53.53 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.458 -1.457 . . . . 7.3200000000000003 109.458 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.97 133.31 39.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -1.148 . . . . 12.85 109.496 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . 0.478 ' HB ' ' CG ' ' A' ' 123' ' ' ARG . 14.8 t -99.17 148.35 24.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.264 -0.898 . . . . 3.3300000000000001 109.444 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . 0.495 ' N ' HD12 ' A' ' 101' ' ' LEU . . . -156.88 -158.95 9.17 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.624 -1.391 . . . . 1.1000000000000001 109.624 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.576 ' CE2' ' HG2' ' A' ' 121' ' ' GLU . 96.5 m-85 -116.08 110.48 18.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.318 -1.107 . . . . 1.98 109.609 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ILE . . . . . 0.485 HG22 ' CD1' ' A' ' 101' ' ' LEU . 33.3 pt -105.99 157.62 34.34 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.289 -0.882 . . . . 1.74 109.293 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.458 ' HB2' ' HB2' ' A' ' 137' ' ' TYR . 3.0 Cg_exo -60.46 124.41 15.07 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.121 1.881 . . . . 1.51 110.158 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 81.0 p -65.17 -33.64 76.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.233 -0.917 . . . . 1.6399999999999999 109.552 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.0 -9.35 58.45 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -0.938 . . . . 2.2599999999999998 109.531 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . 0.458 ' HB2' ' HB2' ' A' ' 134' ' ' PRO . 3.0 m-85 -97.67 6.9 47.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.905 . . . . 1.4299999999999999 109.61 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' VAL . . . . . 0.456 ' HA ' ' O ' ' A' ' 88' ' ' VAL . 9.1 m -133.2 155.02 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 1.01 109.565 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -147.79 148.56 30.76 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.317 -0.864 . . . . 2.46 109.424 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.96 134.35 52.68 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.148 1.898 . . . . 4.2199999999999998 110.222 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 117.963 -1.018 . . . . 7.9699999999999998 109.512 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.473 -0.565 . . . . 14.13 109.473 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.573 HG22 ' HE1' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -142.96 73.66 1.41 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.285 -0.884 . . . . 10.64 109.421 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 86' ' ' LEU . 1.9 mm? -90.57 121.13 32.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 4.3 109.515 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.573 ' HE1' HG22 ' A' ' 85' ' ' THR . 31.2 m-85 -117.85 162.14 18.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 1.32 109.425 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.464 ' O ' ' HA ' ' A' ' 138' ' ' VAL . 1.5 t -127.37 152.46 35.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 1.18 109.468 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.453 ' HA ' ' O ' ' A' ' 137' ' ' TYR . . . -82.64 112.91 19.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.289 -0.882 . . . . 1.13 109.431 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.572 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . 1.0 OUTLIER -71.17 -14.19 62.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 1.58 109.524 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.572 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 7.3 m-85 -150.89 160.14 44.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.216 -0.927 . . . . 2.84 109.463 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.07 153.14 38.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.306 -0.871 . . . . 2.55 109.429 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -139.57 138.21 36.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.182 -0.949 . . . . 1.55 109.443 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 95' ' ' ALA . 46.6 mt-10 -109.29 95.97 5.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.247 -0.908 . . . . 3.36 109.43 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.628 ' HB2' ' C ' ' A' ' 101' ' ' LEU . . . -45.15 123.35 3.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.25 -0.906 . . . . 7.45 109.457 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -3.33 21.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.257 -0.902 . . . . 13.16 109.422 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.76 169.95 15.01 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.201 -0.937 . . . . 9.5 109.232 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -84.09 10.61 9.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.215 -0.928 . . . . 12.04 109.49 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -111.71 -21.46 11.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.266 -0.896 . . . . 4.87 109.516 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -96.88 171.0 8.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 3.18 109.569 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.845 HD12 HG23 ' A' ' 133' ' ' ILE . 1.1 mt -115.73 169.84 8.91 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.23 -0.919 . . . . 1.73 109.509 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.2 p -127.08 140.22 52.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 1.51 109.488 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.416 ' CD2' ' CZ ' ' A' ' 109' ' ' PHE . 18.4 p90 -165.19 -169.19 1.57 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.22 109.553 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.5 m80 -129.09 155.3 45.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.265 -0.897 . . . . 1.97 109.404 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 91' ' ' TYR . 7.9 tttm -53.18 122.23 9.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 2.83 109.509 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 119.67 -6.98 12.35 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.648 -1.381 . . . . 1.82 109.648 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.19 155.25 26.26 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -1.181 . . . . 1.5 109.489 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -100.91 156.95 17.09 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.248 -0.907 . . . . 2.46 109.415 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.704 ' HB3' ' HB1' ' A' ' 122' ' ' ALA . 64.8 m-85 -149.92 147.05 27.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 1.18 109.454 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -106.69 99.43 9.01 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 1.12 109.516 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.586 HD13 ' HB2' ' A' ' 122' ' ' ALA . 41.8 mm -67.29 118.85 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 1.09 109.398 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.8 mt -106.41 -32.15 8.25 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 2.33 109.408 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -142.28 101.37 3.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.258 -0.901 . . . . 3.11 109.613 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . 0.572 ' HB3' ' CD2' ' A' ' 120' ' ' TRP . 0.0 OUTLIER -95.97 -72.58 0.63 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.295 -0.878 . . . . 3.3 109.292 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . 0.537 ' O ' ' CG ' ' A' ' 116' ' ' GLU . 14.3 t 55.7 42.3 29.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -0.84 . . . . 16.7 109.733 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.537 ' CG ' ' O ' ' A' ' 115' ' ' SER . 12.3 pt-20 40.39 -162.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.56 -0.712 . . . . 40.0 109.833 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 118' ' ' ASP . . . 111.11 -86.26 0.42 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.52 -1.432 . . . . 31.11 109.52 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' A' ' 117' ' ' GLY . 1.1 m-20 170.59 -31.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.307 -1.113 . . . . 7.49 109.385 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -119.04 106.86 12.83 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 4.02 109.401 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.572 ' CD2' ' HB3' ' A' ' 114' ' ' SER . 24.2 m0 -90.31 158.81 16.97 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 2.23 109.645 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . 0.567 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 3.5 mt-10 -100.49 107.0 18.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 1.61 108.813 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.704 ' HB1' ' HB3' ' A' ' 109' ' ' PHE . . . -117.0 149.76 39.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.053 -1.03 . . . . 2.84 109.941 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . 0.487 ' CG ' ' HB ' ' A' ' 130' ' ' THR . 0.3 OUTLIER -104.26 126.71 51.6 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.345 -0.847 . . . . 1.99 109.222 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.62 122.0 18.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.226 -0.921 . . . . 2.77 109.553 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 12.9 mt -77.92 -17.55 57.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.25 -0.906 . . . . 4.66 109.385 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 56.3 m -83.61 -56.68 3.59 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.317 -0.864 . . . . 8.1 109.507 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.24 -41.17 17.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.2 -0.937 . . . . 11.83 109.392 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.65 -14.56 53.53 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.458 -1.457 . . . . 7.32 109.458 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.97 133.31 39.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -1.148 . . . . 12.85 109.496 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . 0.487 ' HB ' ' CG ' ' A' ' 123' ' ' ARG . 14.8 t -99.17 148.35 24.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.264 -0.898 . . . . 3.33 109.444 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . 0.752 ' CA ' HD11 ' A' ' 101' ' ' LEU . . . -156.88 -158.95 9.17 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.624 -1.391 . . . . 1.1 109.624 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.567 ' CE2' ' HG2' ' A' ' 121' ' ' GLU . 96.5 m-85 -116.08 110.48 18.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.318 -1.107 . . . . 1.98 109.609 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ILE . . . . . 0.845 HG23 HD12 ' A' ' 101' ' ' LEU . 33.3 pt -105.99 157.62 34.34 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.289 -0.882 . . . . 1.74 109.293 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' A' ' 133' ' ' ILE . 3.0 Cg_exo -60.46 124.41 15.07 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.121 1.881 . . . . 1.51 110.158 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 81.0 p -65.17 -33.64 76.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.233 -0.917 . . . . 1.64 109.552 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.0 -9.35 58.45 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -0.938 . . . . 2.26 109.531 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' TYR . . . . . 0.453 ' O ' ' HA ' ' A' ' 89' ' ' ALA . 3.0 m-85 -97.67 6.9 47.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.905 . . . . 1.43 109.61 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' VAL . . . . . 0.758 HG11 ' CD1' ' A' ' 133' ' ' ILE . 9.1 m -133.2 155.02 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 1.01 109.565 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.458 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -147.79 148.56 30.76 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.317 -0.864 . . . . 2.46 109.424 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.96 134.35 52.68 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.148 1.898 . . . . 4.22 110.222 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 117.963 -1.018 . . . . 7.97 109.512 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 7.8 m . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.473 -0.565 . . . . 14.130000000000001 109.473 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.573 HG22 ' HE1' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -142.96 73.66 1.41 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.285 -0.884 . . . . 10.640000000000001 109.421 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.453 HD13 ' HA ' ' A' ' 86' ' ' LEU . 1.9 mm? -90.57 121.13 32.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.218 -0.926 . . . . 4.2999999999999998 109.515 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.573 ' HE1' HG22 ' A' ' 85' ' ' THR . 31.2 m-85 -117.85 162.14 18.59 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.236 -0.915 . . . . 1.3200000000000001 109.425 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.464 ' O ' ' HA ' ' A' ' 138' ' ' VAL . 1.5 t -127.37 152.46 35.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 1.1799999999999999 109.468 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.453 ' HA ' ' O ' ' A' ' 137' ' ' TYR . . . -82.64 112.91 19.95 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.289 -0.882 . . . . 1.1299999999999999 109.431 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.572 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . 1.0 OUTLIER -71.17 -14.19 62.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.265 -0.897 . . . . 1.5800000000000001 109.524 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.572 ' CE2' ' HB2' ' A' ' 90' ' ' LEU . 7.3 m-85 -150.89 160.14 44.1 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.216 -0.927 . . . . 2.8399999999999999 109.463 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -75.07 153.14 38.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.306 -0.871 . . . . 2.5499999999999998 109.429 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -139.57 138.21 36.04 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.182 -0.949 . . . . 1.55 109.443 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' A' ' 95' ' ' ALA . 46.6 mt-10 -109.29 95.97 5.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.247 -0.908 . . . . 3.3599999999999999 109.43 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.628 ' HB2' ' C ' ' A' ' 101' ' ' LEU . . . -45.15 123.35 3.9 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.25 -0.906 . . . . 7.4500000000000002 109.457 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.35 -3.33 21.23 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.257 -0.902 . . . . 13.16 109.422 179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.76 169.95 15.01 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.201 -0.937 . . . . 9.5 109.232 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -84.09 10.61 9.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.215 -0.928 . . . . 12.039999999999999 109.49 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -111.71 -21.46 11.67 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.266 -0.896 . . . . 4.8700000000000001 109.516 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -96.88 171.0 8.78 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.215 -0.928 . . . . 3.1800000000000002 109.569 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.845 HD12 HG23 ' A' ' 133' ' ' ILE . 1.1 mt -115.73 169.84 8.91 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.23 -0.919 . . . . 1.73 109.509 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.2 p -127.08 140.22 52.43 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.254 -0.904 . . . . 1.51 109.488 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.416 ' CD2' ' CZ ' ' A' ' 109' ' ' PHE . 18.4 p90 -165.19 -169.19 1.57 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.193 -0.942 . . . . 1.22 109.553 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.5 m80 -129.09 155.3 45.67 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.265 -0.897 . . . . 1.97 109.404 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 91' ' ' TYR . 7.9 tttm -53.18 122.23 9.07 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.273 -0.892 . . . . 2.8300000000000001 109.509 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 119.67 -6.98 12.35 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.648 -1.381 . . . . 1.8200000000000001 109.648 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -81.19 155.25 26.26 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.193 -1.181 . . . . 1.5 109.489 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -100.91 156.95 17.09 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.248 -0.907 . . . . 2.46 109.415 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.704 ' HB3' ' HB1' ' A' ' 122' ' ' ALA . 64.8 m-85 -149.92 147.05 27.45 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.257 -0.902 . . . . 1.1799999999999999 109.454 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -106.69 99.43 9.01 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.253 -0.905 . . . . 1.1200000000000001 109.516 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.586 HD13 ' HB2' ' A' ' 122' ' ' ALA . 41.8 mm -67.29 118.85 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.212 -0.93 . . . . 1.0900000000000001 109.398 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.8 mt -106.41 -32.15 8.25 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 2.3300000000000001 109.408 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -142.28 101.37 3.89 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.258 -0.901 . . . . 3.1099999999999999 109.613 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . 0.572 ' HB3' ' CD2' ' A' ' 120' ' ' TRP . 0.0 OUTLIER -95.97 -72.58 0.63 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.295 -0.878 . . . . 3.2999999999999998 109.292 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . 0.537 ' O ' ' CG ' ' A' ' 116' ' ' GLU . 14.3 t 55.7 42.3 29.47 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.356 -0.84 . . . . 16.699999999999999 109.733 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.537 ' CG ' ' O ' ' A' ' 115' ' ' SER . 12.3 pt-20 40.39 -162.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.56 -0.712 . . . . 40.0 109.833 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLY . . . . . 0.418 ' O ' ' CB ' ' A' ' 118' ' ' ASP . . . 111.11 -86.26 0.42 Allowed Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.52 -1.432 . . . . 31.109999999999999 109.52 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' A' ' 117' ' ' GLY . 1.1 m-20 170.59 -31.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.307 -1.113 . . . . 7.4900000000000002 109.385 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' TRP . . . . . . . . . . . . . 99.5 m95 -119.04 106.86 12.83 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.304 -0.873 . . . . 4.0199999999999996 109.401 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.572 ' CD2' ' HB3' ' A' ' 114' ' ' SER . 24.2 m0 -90.31 158.81 16.97 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 2.23 109.645 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.567 ' HG2' ' CE2' ' A' ' 132' ' ' TYR . 3.5 mt-10 -100.49 107.0 18.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.32 -0.863 . . . . 1.6100000000000001 108.813 179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.704 ' HB1' ' HB3' ' A' ' 109' ' ' PHE . . . -117.0 149.76 39.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.053 -1.03 . . . . 2.8399999999999999 109.941 -179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . 0.487 ' CG ' ' HB ' ' A' ' 130' ' ' THR . 0.3 OUTLIER -104.26 126.71 51.6 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.345 -0.847 . . . . 1.99 109.222 179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -69.62 122.0 18.23 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.226 -0.921 . . . . 2.77 109.553 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 12.9 mt -77.92 -17.55 57.13 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.25 -0.906 . . . . 4.6600000000000001 109.385 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 56.3 m -83.61 -56.68 3.59 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.317 -0.864 . . . . 8.0999999999999996 109.507 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.24 -41.17 17.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.2 -0.937 . . . . 11.83 109.392 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 103.65 -14.56 53.53 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.458 -1.457 . . . . 7.3200000000000003 109.458 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -76.97 133.31 39.22 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.249 -1.148 . . . . 12.85 109.496 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . 0.487 ' HB ' ' CG ' ' A' ' 123' ' ' ARG . 14.8 t -99.17 148.35 24.18 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.264 -0.898 . . . . 3.3300000000000001 109.444 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . 0.752 ' CA ' HD11 ' A' ' 101' ' ' LEU . . . -156.88 -158.95 9.17 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.624 -1.391 . . . . 1.1000000000000001 109.624 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.567 ' CE2' ' HG2' ' A' ' 121' ' ' GLU . 96.5 m-85 -116.08 110.48 18.93 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.318 -1.107 . . . . 1.98 109.609 -179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ILE . . . . . 0.845 HG23 HD12 ' A' ' 101' ' ' LEU . 33.3 pt -105.99 157.62 34.34 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.289 -0.882 . . . . 1.74 109.293 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' A' ' 133' ' ' ILE . 3.0 Cg_exo -60.46 124.41 15.07 Favored 'Trans proline' 0 C--N 1.309 -1.534 0 C-N-CA 122.121 1.881 . . . . 1.51 110.158 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 81.0 p -65.17 -33.64 76.5 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.233 -0.917 . . . . 1.6399999999999999 109.552 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.0 -9.35 58.45 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.199 -0.938 . . . . 2.2599999999999998 109.531 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . 0.453 ' O ' ' HA ' ' A' ' 89' ' ' ALA . 3.0 m-85 -97.67 6.9 47.34 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.905 . . . . 1.4299999999999999 109.61 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' VAL . . . . . 0.758 HG11 ' CD1' ' A' ' 133' ' ' ILE . 9.1 m -133.2 155.02 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 1.01 109.565 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.458 ' HB2' HD11 ' A' ' 90' ' ' LEU . . . -147.79 148.56 30.76 Favored Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.317 -0.864 . . . . 2.46 109.424 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -60.96 134.35 52.68 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.148 1.898 . . . . 4.2199999999999998 110.222 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 117.963 -1.018 . . . . 7.9699999999999998 109.512 179.986 . . . . . . . . 0 0 . 1 stop_ save_