data_1azg_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 1azg _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 ' 91' ' ' PRO . . . . . 0.431 ' CB ' ' HD2' ' A' ' 92' ' ' PRO . 3.0 Cg_exo . . . . . 0 N--CA 1.496 1.673 0 N-CA-C 109.648 -0.943 . . . . 7.0099999999999998 109.648 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.431 ' HD2' ' CB ' ' A' ' 91' ' ' PRO . 2.9 Cg_endo -61.47 116.47 3.43 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.355 2.036 . . . . 4.2300000000000004 110.128 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ARG . . . . . 0.598 ' HB3' ' CD1' ' B' ' 119' ' ' TRP . 4.7 mmp_? -44.31 135.05 4.31 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.238 -0.914 . . . . 6.5300000000000002 109.524 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.72 -63.0 0.11 Allowed 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 122.213 1.942 . . . . 2.98 110.154 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.499 ' CD2' ' HB3' ' B' ' 136' ' ' ASN . 0.5 OUTLIER 67.31 98.4 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.269 -0.894 . . . . 1.9099999999999999 109.384 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 97' ' ' VAL . 2.9 Cg_endo -61.17 98.1 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.292 1.995 . . . . 1.2 110.208 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 98' ' ' ALA . 72.7 t -44.53 124.67 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.2 -0.937 . . . . 2.8500000000000001 109.541 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.546 ' CB ' ' HD2' ' A' ' 99' ' ' PRO . . . -47.51 173.05 0.05 OUTLIER Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 1.75 109.425 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.546 ' HD2' ' CB ' ' A' ' 98' ' ' ALA . 3.0 Cg_endo -60.78 83.3 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.374 2.049 . . . . 2.5699999999999998 110.47 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.442 ' C ' ' O ' ' A' ' 99' ' ' PRO . . . 41.62 -160.54 0.03 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.744 -1.343 . . . . 4.3300000000000001 109.744 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.436 ' O ' ' OG ' ' A' ' 102' ' ' SER . 23.9 m -80.82 75.02 7.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -1.133 . . . . 6.6900000000000004 109.527 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 101' ' ' SER . 1.3 p 48.85 60.5 3.67 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.192 -0.942 . . . . 8.5099999999999998 109.415 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 mttt -97.75 129.34 44.78 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 12.41 109.511 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.008 -0.996 . . . . 13.0 109.349 -179.947 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' VAL . . . . . 0.454 ' O ' ' CG1' ' B' ' 84' ' ' VAL . 8.3 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.478 -0.564 . . . . 3.0099999999999998 109.478 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.64 71.58 0.94 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.213 -0.93 . . . . 2.1699999999999999 109.514 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.438 ' O ' HG22 ' B' ' 141' ' ' VAL . 3.4 mm? -99.45 124.32 44.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 2.0499999999999998 109.337 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' PHE . . . . . 0.488 ' HA ' ' O ' ' B' ' 139' ' ' ALA . 17.7 m-85 -118.37 141.39 48.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.203 -0.936 . . . . 2.1699999999999999 109.648 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' VAL . . . . . 0.412 HG12 ' HD3' ' B' ' 108' ' ' LYS . 1.4 t -106.9 153.43 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 1.1799999999999999 109.46 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ALA . . . . . 0.562 ' HB3' ' CE2' ' B' ' 103' ' ' PHE . . . -80.27 116.18 20.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.239 -0.913 . . . . 1.0800000000000001 109.418 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.454 HD12 ' HB1' ' B' ' 139' ' ' ALA . 8.3 mt -74.19 -9.95 59.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.227 -0.921 . . . . 1.1499999999999999 109.426 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -149.5 173.89 13.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.264 -0.897 . . . . 2.5 109.497 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . 0.445 ' HA ' ' HA ' ' B' ' 104' ' ' HIS . 16.9 p30 -92.24 170.81 9.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.875 . . . . 1.8799999999999999 109.436 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -165.19 135.29 3.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 2.2599999999999998 109.334 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.05 108.35 19.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.199 -0.938 . . . . 2.6099999999999999 109.392 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.408 ' HB1' ' C ' ' B' ' 101' ' ' LEU . . . -56.28 106.1 0.25 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 1.3400000000000001 109.447 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . 0.531 ' CB ' ' CZ ' ' B' ' 96' ' ' ARG . 0.0 OUTLIER -86.92 10.71 15.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 5.0099999999999998 109.42 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' THR . . . . . 0.482 HG22 ' HG2' ' B' ' 96' ' ' ARG . 10.6 p -146.84 169.45 19.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.295 -0.878 . . . . 1.8999999999999999 109.257 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -80.3 1.36 28.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.177 -0.952 . . . . 2.79 109.408 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.67 -55.84 2.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 1.9199999999999999 109.511 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ASP . . . . . 0.475 ' OD1' ' CZ3' ' B' ' 119' ' ' TRP . 6.6 m-20 -64.57 -176.51 0.25 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 1.7 109.573 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' LEU . . . . . 0.523 ' CG ' ' HA3' ' B' ' 131' ' ' GLY . 1.8 mt -128.15 179.87 5.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.276 -0.89 . . . . 1.1799999999999999 109.603 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 59.9 p -133.03 140.79 47.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.234 -0.916 . . . . 1.8200000000000001 109.252 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.562 ' CE2' ' HB3' ' B' ' 89' ' ' ALA . 33.6 p90 -174.58 -172.34 0.65 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 1.6200000000000001 109.814 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' HIS . . . . . 0.445 ' HA ' ' HA ' ' B' ' 92' ' ' ASP . 60.9 m-70 -138.13 161.79 35.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.372 -0.83 . . . . 3.2999999999999998 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' LYS . . . . . 0.482 ' HA ' ' O ' ' B' ' 89' ' ' ALA . 2.9 ptpp? -49.51 138.2 13.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.124 -0.985 . . . . 3.5800000000000001 109.425 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.89 -5.16 56.37 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.656 -1.377 . . . . 0.34999999999999998 109.656 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -85.57 129.85 34.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -1.172 . . . . 2.04 109.484 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . 0.412 ' HD3' HG12 ' B' ' 88' ' ' VAL . 21.6 mmtm -76.38 154.67 34.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.898 . . . . 2.7400000000000002 109.477 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' PHE . . . . . 0.414 ' HZ ' ' CG ' ' B' ' 103' ' ' PHE . 21.1 m-85 -148.37 144.03 27.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 1.99 109.468 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' GLN . . . . . 0.461 ' O ' HD22 ' B' ' 112' ' ' LEU . 2.5 mm-40 -105.99 97.25 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.265 -0.897 . . . . 2.1400000000000001 109.438 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' ILE . . . . . 0.414 HD12 ' CB ' ' B' ' 122' ' ' ALA . 29.5 mm -68.56 110.55 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.205 -0.934 . . . . 1.1299999999999999 109.541 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' LEU . . . . . 0.461 HD22 ' O ' ' B' ' 110' ' ' GLN . 4.5 mt -91.8 -43.21 9.66 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.26 -0.9 . . . . 1.3700000000000001 109.267 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ASN . . . . . 0.44 ' O ' ' HB3' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -132.14 122.27 25.07 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.376 -0.828 . . . . 2.02 109.419 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' SER . . . . . 0.569 ' CB ' ' CD2' ' B' ' 120' ' ' TRP . 5.3 p -135.79 52.83 1.98 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.245 -0.909 . . . . 1.5 109.535 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' SER . . . . . 0.504 ' O ' ' O ' ' B' ' 116' ' ' GLU . 86.6 p -120.92 -30.3 4.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.234 -0.916 . . . . 2.1800000000000002 109.388 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' GLU . . . . . 0.552 ' O ' ' O ' ' B' ' 117' ' ' GLY . 12.7 pt-20 -57.23 -153.36 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 4.0999999999999996 109.548 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' GLY . . . . . 0.552 ' O ' ' O ' ' B' ' 116' ' ' GLU . . . -52.29 -161.69 0.01 OUTLIER Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.964 -1.254 . . . . 2.1899999999999999 109.964 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' B' ' 118' ' ' ASP . 1.0 OUTLIER -74.26 2.06 10.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.223 -1.163 . . . . 1.74 110.003 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' TRP . . . . . 0.598 ' CD1' ' HB3' ' A' ' 93' ' ' ARG . 18.9 m95 -107.49 127.41 53.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.109 -0.995 . . . . 0.59999999999999998 109.701 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.582 ' CZ2' ' HB2' ' B' ' 135' ' ' SER . 18.2 m0 -109.53 169.2 8.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.893 . . . . 0.62 109.382 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -104.48 111.12 23.66 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.276 -0.89 . . . . 1.73 109.211 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' ALA . . . . . 0.414 ' CB ' HD12 ' B' ' 111' ' ' ILE . . . -108.54 158.57 17.44 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.202 -0.936 . . . . 1.1200000000000001 109.58 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' ARG . . . . . 0.478 ' CB ' HG21 ' B' ' 130' ' ' THR . 2.0 tmm_? -112.14 123.97 51.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.296 -0.878 . . . . 2.6899999999999999 109.34 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' SER . . . . . 0.432 ' HB3' ' OG1' ' B' ' 127' ' ' THR . 0.1 OUTLIER -65.14 117.1 7.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.168 -0.957 . . . . 1.6899999999999999 109.479 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 45.3 mt -71.57 -15.98 62.29 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -0.927 . . . . 1.49 109.52 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 42.5 m -89.92 -68.0 0.81 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 1.4299999999999999 109.456 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' THR . . . . . 0.502 ' CB ' ' OE2' ' B' ' 129' ' ' GLU . 44.1 p -65.51 -51.23 61.52 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.295 -0.878 . . . . 1.5900000000000001 109.383 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 110.23 -12.71 31.22 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.648 -1.381 . . . . 0.71999999999999997 109.648 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' GLU . . . . . 0.502 ' OE2' ' CB ' ' B' ' 127' ' ' THR . 0.8 OUTLIER -81.15 139.97 35.27 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.233 -1.157 . . . . 2.29 109.327 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' THR . . . . . 0.478 HG21 ' CB ' ' B' ' 123' ' ' ARG . 0.2 OUTLIER -97.02 160.68 14.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.937 . . . . 1.6200000000000001 109.577 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLY . . . . . 0.523 ' HA3' ' CG ' ' B' ' 101' ' ' LEU . . . -168.87 -170.58 33.68 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.482 -1.447 . . . . 0.39000000000000001 109.482 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' TYR . . . . . 0.404 ' CD1' ' N ' ' B' ' 132' ' ' TYR . 47.7 m-85 -115.26 121.86 44.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -1.187 . . . . 2.27 109.601 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' ILE . . . . . 0.552 ' CD1' ' CG1' ' B' ' 138' ' ' VAL . 1.1 pt -121.19 159.5 49.39 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.274 -0.891 . . . . 1.5 109.309 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' PRO . . . . . 0.519 ' HD2' ' HB ' ' B' ' 133' ' ' ILE . 3.1 Cg_exo -59.9 125.54 17.97 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.169 1.913 . . . . 0.40000000000000002 110.152 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' SER . . . . . 0.582 ' HB2' ' CZ2' ' B' ' 120' ' ' TRP . 71.8 p -66.18 -30.05 70.45 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.252 -0.905 . . . . 0.94999999999999996 109.582 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' ASN . . . . . 0.499 ' HB3' ' CD2' ' A' ' 95' ' ' LEU . 0.0 OUTLIER -75.07 1.37 13.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.175 -0.953 . . . . 2.1600000000000001 109.479 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -109.1 11.45 25.67 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 2.27 109.588 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' VAL . . . . . 0.552 ' CG1' ' CD1' ' B' ' 133' ' ' ILE . 34.5 m -142.95 151.63 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.145 -0.972 . . . . 1.1899999999999999 109.643 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' ALA . . . . . 0.488 ' O ' ' HA ' ' B' ' 87' ' ' PHE . . . -145.76 160.97 42.4 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.249 -0.907 . . . . 1.1299999999999999 109.36 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -60.42 149.1 88.08 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.343 2.029 . . . . 0.71999999999999997 110.175 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' VAL . . . . . 0.438 HG22 ' O ' ' B' ' 86' ' ' LEU . 98.8 t . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.99 -1.005 . . . . 2.0 109.448 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.445 ' CB ' ' HD2' ' A' ' 92' ' ' PRO . 3.0 Cg_exo . . . . . 0 N--CA 1.496 1.673 0 N-CA-C 109.648 -0.943 . . . . 6.2300000000000004 109.648 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 91' ' ' PRO . 2.9 Cg_endo -61.47 116.47 3.43 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.355 2.036 . . . . 3.75 110.128 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ARG . . . . . 0.604 ' HB3' ' CD1' ' B' ' 119' ' ' TRP . 4.7 mmp_? -44.31 135.05 4.31 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.238 -0.914 . . . . 5.8600000000000003 109.524 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.72 -63.0 0.11 Allowed 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 122.213 1.942 . . . . 2.46 110.154 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' B' ' 136' ' ' ASN . 0.5 OUTLIER 67.31 98.4 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.269 -0.894 . . . . 1.3400000000000001 109.384 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 97' ' ' VAL . 2.9 Cg_endo -61.17 98.1 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.292 1.995 . . . . 1.2 110.208 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 98' ' ' ALA . 72.7 t -44.53 124.67 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.2 -0.937 . . . . 2.2999999999999998 109.541 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.971 ' HB1' ' HD2' ' A' ' 99' ' ' PRO . . . -47.51 173.05 0.05 OUTLIER Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 1.55 109.425 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.971 ' HD2' ' HB1' ' A' ' 98' ' ' ALA . 3.0 Cg_endo -60.78 83.3 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.374 2.049 . . . . 2.5299999999999998 110.47 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.442 ' C ' ' O ' ' A' ' 99' ' ' PRO . . . 41.62 -160.54 0.03 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.744 -1.343 . . . . 4.3300000000000001 109.744 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.432 ' O ' ' OG ' ' A' ' 102' ' ' SER . 23.9 m -80.82 75.02 7.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -1.133 . . . . 6.5800000000000001 109.527 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 101' ' ' SER . 1.3 p 48.85 60.5 3.67 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.192 -0.942 . . . . 8.5099999999999998 109.415 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 mttt -97.75 129.34 44.78 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 12.119999999999999 109.511 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.008 -0.996 . . . . 12.75 109.349 -179.947 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 84' ' ' VAL . . . . . 0.609 HG13 ' O ' ' B' ' 84' ' ' VAL . 8.3 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.478 -0.564 . . . . 2.5499999999999998 109.478 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' THR . . . . . 0.593 HG22 ' CE1' ' B' ' 87' ' ' PHE . 0.1 OUTLIER -152.64 71.58 0.94 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.213 -0.93 . . . . 1.6599999999999999 109.514 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.666 ' O ' HG23 ' B' ' 141' ' ' VAL . 3.4 mm? -99.45 124.32 44.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 1.4299999999999999 109.337 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' PHE . . . . . 0.593 ' CE1' HG22 ' B' ' 85' ' ' THR . 17.7 m-85 -118.37 141.39 48.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.203 -0.936 . . . . 1.29 109.648 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' VAL . . . . . 0.402 HG13 ' HD3' ' B' ' 108' ' ' LYS . 1.4 t -106.9 153.43 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.34999999999999998 109.46 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ALA . . . . . 0.574 ' HB1' ' HE2' ' B' ' 103' ' ' PHE . . . -80.27 116.18 20.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.239 -0.913 . . . . 0.28000000000000003 109.418 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' B' ' 139' ' ' ALA . 8.3 mt -74.19 -9.95 59.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.227 -0.921 . . . . 0.44 109.426 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -149.5 173.89 13.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.264 -0.897 . . . . 2.1000000000000001 109.497 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.458 ' HA ' ' HA ' ' B' ' 104' ' ' HIS . 16.9 p30 -92.24 170.81 9.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.875 . . . . 1.8799999999999999 109.436 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -165.19 135.29 3.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 1.3700000000000001 109.334 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.05 108.35 19.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.199 -0.938 . . . . 2.6099999999999999 109.392 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.827 ' HB2' ' C ' ' B' ' 101' ' ' LEU . . . -56.28 106.1 0.25 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.71999999999999997 109.447 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ARG . . . . . 0.653 ' HG2' HG23 ' B' ' 97' ' ' THR . 0.0 OUTLIER -86.92 10.71 15.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 4.3399999999999999 109.42 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 97' ' ' THR . . . . . 0.653 HG23 ' HG2' ' B' ' 96' ' ' ARG . 10.6 p -146.84 169.45 19.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.295 -0.878 . . . . 1.4099999999999999 109.257 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -80.3 1.36 28.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.177 -0.952 . . . . 2.79 109.408 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.67 -55.84 2.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 1.9199999999999999 109.511 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ASP . . . . . 0.475 ' OD1' ' CZ3' ' B' ' 119' ' ' TRP . 6.6 m-20 -64.57 -176.51 0.25 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 1.7 109.573 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 101' ' ' LEU . . . . . 0.99 HD12 HG23 ' B' ' 133' ' ' ILE . 1.8 mt -128.15 179.87 5.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.276 -0.89 . . . . 0.42999999999999999 109.603 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 59.9 p -133.03 140.79 47.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.234 -0.916 . . . . 1.46 109.252 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.574 ' HE2' ' HB1' ' B' ' 89' ' ' ALA . 33.6 p90 -174.58 -172.34 0.65 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.93999999999999995 109.814 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' HIS . . . . . 0.458 ' HA ' ' HA ' ' B' ' 92' ' ' ASP . 71.5 m80 -138.13 161.79 35.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.372 -0.83 . . . . 2.6600000000000001 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' LYS . . . . . 0.493 ' O ' ' HG3' ' B' ' 105' ' ' LYS . 2.9 ptpp? -49.51 138.2 13.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.124 -0.985 . . . . 3.1600000000000001 109.425 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.89 -5.16 56.37 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.656 -1.377 . . . . 0.33000000000000002 109.656 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -85.57 129.85 34.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -1.172 . . . . 2.04 109.484 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 108' ' ' LYS . . . . . 0.402 ' HD3' HG13 ' B' ' 88' ' ' VAL . 21.6 mmtm -76.38 154.67 34.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.898 . . . . 2.23 109.477 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' PHE . . . . . 0.448 ' HB3' ' HB1' ' B' ' 122' ' ' ALA . 21.1 m-85 -148.37 144.03 27.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 1.1399999999999999 109.468 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -105.99 97.25 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.265 -0.897 . . . . 1.6799999999999999 109.438 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' ILE . . . . . 0.663 HD13 ' HB2' ' B' ' 122' ' ' ALA . 29.5 mm -68.56 110.55 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.205 -0.934 . . . . 0.41999999999999998 109.541 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 mt -91.8 -43.21 9.66 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.26 -0.9 . . . . 0.76000000000000001 109.267 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -132.14 122.27 25.07 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.376 -0.828 . . . . 1.8700000000000001 109.419 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 114' ' ' SER . . . . . 0.569 ' CB ' ' CD2' ' B' ' 120' ' ' TRP . 5.3 p -135.79 52.83 1.98 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.245 -0.909 . . . . 1.26 109.535 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 115' ' ' SER . . . . . 0.504 ' O ' ' O ' ' B' ' 116' ' ' GLU . 86.6 p -120.92 -30.3 4.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.234 -0.916 . . . . 1.8400000000000001 109.388 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 116' ' ' GLU . . . . . 0.552 ' O ' ' O ' ' B' ' 117' ' ' GLY . 12.7 pt-20 -57.23 -153.36 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 4.0999999999999996 109.548 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 117' ' ' GLY . . . . . 0.552 ' O ' ' O ' ' B' ' 116' ' ' GLU . . . -52.29 -161.69 0.01 OUTLIER Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.964 -1.254 . . . . 1.75 109.964 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.511 ' HB3' HD11 ' A' ' 95' ' ' LEU . 1.0 OUTLIER -74.26 2.06 10.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.223 -1.163 . . . . 1.74 110.003 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 119' ' ' TRP . . . . . 0.604 ' CD1' ' HB3' ' A' ' 93' ' ' ARG . 18.9 m95 -107.49 127.41 53.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.109 -0.995 . . . . 0.47999999999999998 109.701 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.606 ' CZ2' ' HB2' ' B' ' 135' ' ' SER . 18.2 m0 -109.53 169.2 8.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.893 . . . . 0.53000000000000003 109.382 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -104.48 111.12 23.66 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.276 -0.89 . . . . 1.73 109.211 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' ALA . . . . . 0.663 ' HB2' HD13 ' B' ' 111' ' ' ILE . . . -108.54 158.57 17.44 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.202 -0.936 . . . . 0.33000000000000002 109.58 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 123' ' ' ARG . . . . . 0.491 ' CB ' HG23 ' B' ' 130' ' ' THR . 2.0 tmm_? -112.14 123.97 51.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.296 -0.878 . . . . 2.1299999999999999 109.34 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' SER . . . . . 0.453 ' HB3' ' OG1' ' B' ' 127' ' ' THR . 0.1 OUTLIER -65.14 117.1 7.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.168 -0.957 . . . . 1.3400000000000001 109.479 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.534 HD11 HD11 ' B' ' 86' ' ' LEU . 45.3 mt -71.57 -15.98 62.29 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -0.927 . . . . 0.88 109.52 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 42.5 m -89.92 -68.0 0.81 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.90000000000000002 109.456 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 127' ' ' THR . . . . . 0.502 ' CB ' ' OE2' ' B' ' 129' ' ' GLU . 44.1 p -65.51 -51.23 61.52 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.295 -0.878 . . . . 1.0700000000000001 109.383 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 110.23 -12.71 31.22 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.648 -1.381 . . . . 0.71999999999999997 109.648 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' GLU . . . . . 0.502 ' OE2' ' CB ' ' B' ' 127' ' ' THR . 0.8 OUTLIER -81.15 139.97 35.27 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.233 -1.157 . . . . 2.29 109.327 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 130' ' ' THR . . . . . 0.491 HG23 ' CB ' ' B' ' 123' ' ' ARG . 0.2 OUTLIER -97.02 160.68 14.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.937 . . . . 1.21 109.577 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLY . . . . . 0.612 ' CA ' HD11 ' B' ' 101' ' ' LEU . . . -168.87 -170.58 33.68 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.482 -1.447 . . . . 0.34000000000000002 109.482 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' TYR . . . . . 0.404 ' CD1' ' N ' ' B' ' 132' ' ' TYR . 47.7 m-85 -115.26 121.86 44.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -1.187 . . . . 1.3700000000000001 109.601 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 133' ' ' ILE . . . . . 0.99 HG23 HD12 ' B' ' 101' ' ' LEU . 1.1 pt -121.19 159.5 49.39 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.274 -0.891 . . . . 0.85999999999999999 109.309 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' PRO . . . . . 0.538 ' HD2' ' HB ' ' B' ' 133' ' ' ILE . 3.1 Cg_exo -59.9 125.54 17.97 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.169 1.913 . . . . 0.35999999999999999 110.152 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' SER . . . . . 0.606 ' HB2' ' CZ2' ' B' ' 120' ' ' TRP . 71.8 p -66.18 -30.05 70.45 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.252 -0.905 . . . . 0.55000000000000004 109.582 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' ASN . . . . . 0.728 ' HB3' HD21 ' A' ' 95' ' ' LEU . 0.1 OUTLIER -75.07 1.37 13.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.175 -0.953 . . . . 2.1600000000000001 109.479 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -109.1 11.45 25.67 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 1.3700000000000001 109.588 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 138' ' ' VAL . . . . . 0.764 HG11 ' CD1' ' B' ' 133' ' ' ILE . 34.5 m -142.95 151.63 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.145 -0.972 . . . . 0.40000000000000002 109.643 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 139' ' ' ALA . . . . . 0.605 ' HB1' ' HD2' ' B' ' 140' ' ' PRO . . . -145.76 160.97 42.4 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.249 -0.907 . . . . 0.45000000000000001 109.36 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 140' ' ' PRO . . . . . 0.605 ' HD2' ' HB1' ' B' ' 139' ' ' ALA . 3.0 Cg_exo -60.42 149.1 88.08 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.343 2.029 . . . . 0.65000000000000002 110.175 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 141' ' ' VAL . . . . . 0.666 HG23 ' O ' ' B' ' 86' ' ' LEU . 98.8 t . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.99 -1.005 . . . . 1.4199999999999999 109.448 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.445 ' CB ' ' HD2' ' A' ' 92' ' ' PRO . 3.0 Cg_exo . . . . . 0 N--CA 1.496 1.673 0 N-CA-C 109.648 -0.943 . . . . 6.2300000000000004 109.648 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 91' ' ' PRO . 2.9 Cg_endo -61.47 116.47 3.43 Favored 'Trans proline' 0 C--N 1.307 -1.62 0 C-N-CA 122.355 2.036 . . . . 3.75 110.128 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ARG . . . . . 0.604 ' HB3' ' CD1' ' B' ' 119' ' ' TRP . 4.7 mmp_? -44.31 135.05 4.31 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.238 -0.914 . . . . 5.8600000000000003 109.524 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.72 -63.0 0.11 Allowed 'Trans proline' 0 C--N 1.308 -1.592 0 C-N-CA 122.213 1.942 . . . . 2.46 110.154 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' B' ' 136' ' ' ASN . 0.5 OUTLIER 67.31 98.4 0.04 OUTLIER Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.269 -0.894 . . . . 1.3400000000000001 109.384 179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.415 ' O ' ' C ' ' A' ' 97' ' ' VAL . 2.9 Cg_endo -61.17 98.1 0.14 Allowed 'Trans proline' 0 C--N 1.308 -1.561 0 C-N-CA 122.292 1.995 . . . . 1.2 110.208 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.444 ' O ' ' O ' ' A' ' 98' ' ' ALA . 72.7 t -44.53 124.67 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 O-C-N 121.2 -0.937 . . . . 2.2999999999999998 109.541 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.971 ' HB1' ' HD2' ' A' ' 99' ' ' PRO . . . -47.51 173.05 0.05 OUTLIER Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 1.55 109.425 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.971 ' HD2' ' HB1' ' A' ' 98' ' ' ALA . 3.0 Cg_endo -60.78 83.3 0.08 OUTLIER 'Trans proline' 0 C--N 1.307 -1.634 0 C-N-CA 122.374 2.049 . . . . 2.5299999999999998 110.47 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.442 ' C ' ' O ' ' A' ' 99' ' ' PRO . . . 41.62 -160.54 0.03 OUTLIER Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.744 -1.343 . . . . 4.3300000000000001 109.744 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.432 ' O ' ' OG ' ' A' ' 102' ' ' SER . 23.9 m -80.82 75.02 7.76 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -1.133 . . . . 6.5800000000000001 109.527 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 101' ' ' SER . 1.3 p 48.85 60.5 3.67 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.192 -0.942 . . . . 8.5099999999999998 109.415 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 3.2 mttt -97.75 129.34 44.78 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.252 -0.905 . . . . 12.119999999999999 109.511 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.0 m . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.008 -0.996 . . . . 12.75 109.349 -179.947 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' VAL . . . . . 0.609 HG13 ' O ' ' B' ' 84' ' ' VAL . 8.3 p . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.478 -0.564 . . . . 2.5499999999999998 109.478 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' THR . . . . . 0.593 HG22 ' CE1' ' B' ' 87' ' ' PHE . 0.1 OUTLIER -152.64 71.58 0.94 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.213 -0.93 . . . . 1.6599999999999999 109.514 179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.666 ' O ' HG23 ' B' ' 141' ' ' VAL . 3.4 mm? -99.45 124.32 44.5 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.271 -0.893 . . . . 1.4299999999999999 109.337 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' PHE . . . . . 0.593 ' CE1' HG22 ' B' ' 85' ' ' THR . 17.7 m-85 -118.37 141.39 48.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.203 -0.936 . . . . 1.29 109.648 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' VAL . . . . . 0.402 HG13 ' HD3' ' B' ' 108' ' ' LYS . 1.4 t -106.9 153.43 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.34999999999999998 109.46 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ALA . . . . . 0.574 ' HB1' ' HE2' ' B' ' 103' ' ' PHE . . . -80.27 116.18 20.22 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.239 -0.913 . . . . 0.28000000000000003 109.418 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' B' ' 139' ' ' ALA . 8.3 mt -74.19 -9.95 59.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.227 -0.921 . . . . 0.44 109.426 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -149.5 173.89 13.1 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.264 -0.897 . . . . 2.1000000000000001 109.497 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.458 ' HA ' ' HA ' ' B' ' 104' ' ' HIS . 16.9 p30 -92.24 170.81 9.51 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.299 -0.875 . . . . 1.8799999999999999 109.436 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 85.8 t80 -165.19 135.29 3.7 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.201 -0.937 . . . . 1.3700000000000001 109.334 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.05 108.35 19.82 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.199 -0.938 . . . . 2.6099999999999999 109.392 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.827 ' HB2' ' C ' ' B' ' 101' ' ' LEU . . . -56.28 106.1 0.25 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.71999999999999997 109.447 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . 0.653 ' HG2' HG23 ' B' ' 97' ' ' THR . 0.0 OUTLIER -86.92 10.71 15.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.266 -0.896 . . . . 4.3399999999999999 109.42 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' THR . . . . . 0.653 HG23 ' HG2' ' B' ' 96' ' ' ARG . 10.6 p -146.84 169.45 19.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.295 -0.878 . . . . 1.4099999999999999 109.257 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -80.3 1.36 28.99 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.177 -0.952 . . . . 2.79 109.408 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -97.67 -55.84 2.69 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 1.9199999999999999 109.511 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ASP . . . . . 0.475 ' OD1' ' CZ3' ' B' ' 119' ' ' TRP . 6.6 m-20 -64.57 -176.51 0.25 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.156 -0.965 . . . . 1.7 109.573 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' LEU . . . . . 0.99 HD12 HG23 ' B' ' 133' ' ' ILE . 1.8 mt -128.15 179.87 5.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.276 -0.89 . . . . 0.42999999999999999 109.603 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 59.9 p -133.03 140.79 47.91 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.234 -0.916 . . . . 1.46 109.252 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.574 ' HE2' ' HB1' ' B' ' 89' ' ' ALA . 33.6 p90 -174.58 -172.34 0.65 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.197 -0.939 . . . . 0.93999999999999995 109.814 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' HIS . . . . . 0.458 ' HA ' ' HA ' ' B' ' 92' ' ' ASP . 60.9 m-70 -138.13 161.79 35.89 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.372 -0.83 . . . . 2.6600000000000001 109.269 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' LYS . . . . . 0.493 ' O ' ' HG3' ' B' ' 105' ' ' LYS . 2.9 ptpp? -49.51 138.2 13.98 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.124 -0.985 . . . . 3.1600000000000001 109.425 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.89 -5.16 56.37 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.656 -1.377 . . . . 0.33000000000000002 109.656 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -85.57 129.85 34.72 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.207 -1.172 . . . . 2.04 109.484 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.402 ' HD3' HG13 ' B' ' 88' ' ' VAL . 21.6 mmtm -76.38 154.67 34.7 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.264 -0.898 . . . . 2.23 109.477 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' PHE . . . . . 0.448 ' HB3' ' HB1' ' B' ' 122' ' ' ALA . 21.1 m-85 -148.37 144.03 27.24 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.226 -0.921 . . . . 1.1399999999999999 109.468 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -105.99 97.25 7.09 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.265 -0.897 . . . . 1.6799999999999999 109.438 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' ILE . . . . . 0.663 HD13 ' HB2' ' B' ' 122' ' ' ALA . 29.5 mm -68.56 110.55 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.205 -0.934 . . . . 0.41999999999999998 109.541 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 mt -91.8 -43.21 9.66 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.26 -0.9 . . . . 0.76000000000000001 109.267 179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ASN . . . . . 0.434 ' O ' ' HB3' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -132.14 122.27 25.07 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.376 -0.828 . . . . 1.8700000000000001 109.419 179.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' SER . . . . . 0.569 ' CB ' ' CD2' ' B' ' 120' ' ' TRP . 5.3 p -135.79 52.83 1.98 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.245 -0.909 . . . . 1.26 109.535 -179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' SER . . . . . 0.504 ' O ' ' O ' ' B' ' 116' ' ' GLU . 86.6 p -120.92 -30.3 4.43 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.234 -0.916 . . . . 1.8400000000000001 109.388 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' GLU . . . . . 0.552 ' O ' ' O ' ' B' ' 117' ' ' GLY . 12.7 pt-20 -57.23 -153.36 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 4.0999999999999996 109.548 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' GLY . . . . . 0.552 ' O ' ' O ' ' B' ' 116' ' ' GLU . . . -52.29 -161.69 0.01 OUTLIER Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.964 -1.254 . . . . 1.75 109.964 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.511 ' HB3' HD11 ' A' ' 95' ' ' LEU . 1.0 OUTLIER -74.26 2.06 10.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.223 -1.163 . . . . 1.74 110.003 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' TRP . . . . . 0.604 ' CD1' ' HB3' ' A' ' 93' ' ' ARG . 18.9 m95 -107.49 127.41 53.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.109 -0.995 . . . . 0.47999999999999998 109.701 -179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.606 ' CZ2' ' HB2' ' B' ' 135' ' ' SER . 18.2 m0 -109.53 169.2 8.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.272 -0.893 . . . . 0.53000000000000003 109.382 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -104.48 111.12 23.66 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.276 -0.89 . . . . 1.73 109.211 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' ALA . . . . . 0.663 ' HB2' HD13 ' B' ' 111' ' ' ILE . . . -108.54 158.57 17.44 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.202 -0.936 . . . . 0.33000000000000002 109.58 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' ARG . . . . . 0.491 ' CB ' HG23 ' B' ' 130' ' ' THR . 2.0 tmm_? -112.14 123.97 51.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.296 -0.878 . . . . 2.1299999999999999 109.34 179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' SER . . . . . 0.453 ' HB3' ' OG1' ' B' ' 127' ' ' THR . 0.1 OUTLIER -65.14 117.1 7.25 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.168 -0.957 . . . . 1.3400000000000001 109.479 -179.904 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.534 HD11 HD11 ' B' ' 86' ' ' LEU . 45.3 mt -71.57 -15.98 62.29 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -0.927 . . . . 0.88 109.52 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' THR . . . . . . . . . . . . . 42.5 m -89.92 -68.0 0.81 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.90000000000000002 109.456 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' THR . . . . . 0.502 ' CB ' ' OE2' ' B' ' 129' ' ' GLU . 44.1 p -65.51 -51.23 61.52 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.295 -0.878 . . . . 1.0700000000000001 109.383 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . 110.23 -12.71 31.22 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.648 -1.381 . . . . 0.71999999999999997 109.648 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' GLU . . . . . 0.502 ' OE2' ' CB ' ' B' ' 127' ' ' THR . 0.8 OUTLIER -81.15 139.97 35.27 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.233 -1.157 . . . . 2.29 109.327 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' THR . . . . . 0.491 HG23 ' CB ' ' B' ' 123' ' ' ARG . 0.2 OUTLIER -97.02 160.68 14.21 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.2 -0.937 . . . . 1.21 109.577 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLY . . . . . 0.612 ' CA ' HD11 ' B' ' 101' ' ' LEU . . . -168.87 -170.58 33.68 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.482 -1.447 . . . . 0.34000000000000002 109.482 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' TYR . . . . . 0.404 ' CD1' ' N ' ' B' ' 132' ' ' TYR . 47.7 m-85 -115.26 121.86 44.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.183 -1.187 . . . . 1.3700000000000001 109.601 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' ILE . . . . . 0.99 HG23 HD12 ' B' ' 101' ' ' LEU . 1.1 pt -121.19 159.5 49.39 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.274 -0.891 . . . . 0.85999999999999999 109.309 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' PRO . . . . . 0.538 ' HD2' ' HB ' ' B' ' 133' ' ' ILE . 3.1 Cg_exo -59.9 125.54 17.97 Favored 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.169 1.913 . . . . 0.35999999999999999 110.152 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' SER . . . . . 0.606 ' HB2' ' CZ2' ' B' ' 120' ' ' TRP . 71.8 p -66.18 -30.05 70.45 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.252 -0.905 . . . . 0.55000000000000004 109.582 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' ASN . . . . . 0.728 ' HB3' HD21 ' A' ' 95' ' ' LEU . 0.0 OUTLIER -75.07 1.37 13.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.175 -0.953 . . . . 2.1600000000000001 109.479 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -109.1 11.45 25.67 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.244 -0.91 . . . . 1.3700000000000001 109.588 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' VAL . . . . . 0.764 HG11 ' CD1' ' B' ' 133' ' ' ILE . 34.5 m -142.95 151.63 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.145 -0.972 . . . . 0.40000000000000002 109.643 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' ALA . . . . . 0.605 ' HB1' ' HD2' ' B' ' 140' ' ' PRO . . . -145.76 160.97 42.4 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.249 -0.907 . . . . 0.45000000000000001 109.36 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' PRO . . . . . 0.605 ' HD2' ' HB1' ' B' ' 139' ' ' ALA . 3.0 Cg_exo -60.42 149.1 88.08 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 C-N-CA 122.343 2.029 . . . . 0.65000000000000002 110.175 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' VAL . . . . . 0.666 HG23 ' O ' ' B' ' 86' ' ' LEU . 98.8 t . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.99 -1.005 . . . . 1.4199999999999999 109.448 -179.976 . . . . . . . . 1 1 . 1 stop_ save_