data_2abo_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 2abo _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 6' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.904 0.383 . . . . 2.3599999999999999 111.157 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.6 -106.47 2.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.867 -0.683 . . . . 1.0 112.383 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.409 HG21 ' CB ' ' A' ' 11' ' ' ALA . 6.8 m -85.1 -4.28 59.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.55 0.204 . . . . 1.1899999999999999 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.42 -28.07 18.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.97999999999999998 110.358 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 25.8 m95 -75.61 -15.11 60.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.911 -0.586 . . . . 0.58999999999999997 111.246 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.409 ' CB ' HG21 ' A' ' 8' ' ' THR . . . -67.63 -61.01 2.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.879 0.371 . . . . 1.1000000000000001 110.525 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.5 m -53.87 -40.24 66.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.497 . . . . 1.1799999999999999 110.446 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.3 tp -74.83 -29.55 61.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 1.6899999999999999 110.35 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.1 mt -64.13 -43.57 97.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 1.22 110.712 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 5.2 p -69.19 -29.97 68.06 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.301 -0.409 . . . . 1.05 110.646 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -48.35 -64.9 0.67 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.15 -0.477 . . . . 1.0800000000000001 110.376 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.413 ' CE1' ' O ' ' A' ' 92' ' ' PHE . 6.0 t80 -57.44 -29.95 64.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.296 0.57 . . . . 0.33000000000000002 109.766 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.59 ' HB2' ' HA ' ' A' ' 15' ' ' THR . 0.0 OUTLIER -64.38 -50.76 66.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.15 -0.932 . . . . 1.1100000000000001 111.563 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HA ' ' CZ3' ' A' ' 108' ' ' TRP . 1.5 mttt -82.24 -41.09 20.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.997 0.427 . . . . 1.4299999999999999 110.831 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -51.96 -25.34 8.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.646 . . . . 1.3899999999999999 111.59 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 24.0 m -93.32 -25.51 4.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.696 0.284 . . . . 0.0 111.35 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.7 t -94.47 16.5 15.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.193 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt 42.26 92.35 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.143 0.497 . . . . 0.0 111.377 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.425 ' O ' ' CG1' ' A' ' 24' ' ' VAL . 87.0 t -127.21 59.74 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.02 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 45.19 26.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 68.6 96.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.168 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.51 120.73 3.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 2.6499999999999999 110.628 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.43 53.75 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 3.02 111.052 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.78 55.75 1.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 1.95 110.807 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.1 m -150.24 151.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 1.73 111.244 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -71.33 161.49 30.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 2.1600000000000001 110.808 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -28.47 37.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 1.8799999999999999 111.082 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.04 -26.88 15.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.408 -0.36 . . . . 1.1599999999999999 111.404 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.99 -15.46 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.805 0.336 . . . . 1.29 110.776 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt -78.06 -48.91 15.03 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.367 -0.379 . . . . 1.5900000000000001 110.576 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 1.2 t -57.38 -42.08 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 1.3100000000000001 110.877 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -52.98 -40.77 64.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 1.6100000000000001 110.28 179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.34 -30.64 50.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.956 -0.566 . . . . 1.3300000000000001 110.606 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.76 -46.78 57.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 1.3200000000000001 110.871 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -54.08 31.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.149 -0.478 . . . . 2.0499999999999998 110.836 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.8 mt -56.0 -41.83 69.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 1.7 110.889 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -44.18 74.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 1.22 111.005 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m -55.02 -41.0 70.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 1.28 111.02 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -73.59 -35.92 65.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 2.02 110.792 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 24.2 p -64.22 -48.76 74.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 1.01 111.066 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.13 -45.45 88.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 2.1000000000000001 110.896 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.88 -37.43 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 2.25 110.909 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.445 ' CE2' ' HB ' ' A' ' 89' ' ' VAL . 3.5 t80 -66.33 -40.19 89.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 2.4399999999999999 110.836 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -68.04 -42.73 80.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 4.2000000000000002 110.865 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -68.68 -52.0 35.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 4.3700000000000001 110.823 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -64.54 -65.44 0.67 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 3.46 110.883 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -81.71 97.74 8.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 2.8100000000000001 110.88 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -125.49 -48.36 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 2.5099999999999998 110.89 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.6 t -71.51 -35.66 70.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 2.46 110.748 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.7 t -65.31 -21.01 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.106 -0.497 . . . . 2.1800000000000002 111.215 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -64.62 -15.72 61.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.468 -0.333 . . . . 1.8700000000000001 111.246 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -56.76 -21.16 26.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 5.4800000000000004 110.248 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -39.16 -75.98 0.03 OUTLIER 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.892 -0.595 . . . . 1.48 111.5 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.71 49.67 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 2.7400000000000002 111.026 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.9 46.75 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.426 . . . . 1.8899999999999999 110.861 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -147.72 -66.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.742 -0.742 . . . . 1.25 112.479 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -51.25 -39.85 61.72 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.711 2.274 . . . . 1.3600000000000001 112.396 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.09 -28.9 60.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.228 -0.442 . . . . 1.4399999999999999 111.328 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.419 HD12 ' CD1' ' A' ' 67' ' ' TRP . 0.2 OUTLIER -82.71 4.23 25.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 2.3900000000000001 111.502 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.68 -32.92 41.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.481 . . . . 3.5699999999999998 109.972 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -131.47 34.12 3.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.689 -0.687 . . . . 1.9199999999999999 110.342 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.459 ' O ' ' HB2' ' A' ' 71' ' ' LEU . 46.3 p-90 -56.71 -18.69 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.053 -0.522 . . . . 0.55000000000000004 111.575 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HE2' ' CZ2' ' A' ' 67' ' ' TRP . 4.0 mtmt -72.66 -32.42 65.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.307 0.575 . . . . 1.8999999999999999 109.789 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.39 -5.92 19.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.151 -1.055 . . . . 3.8900000000000001 108.151 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -150.01 62.47 0.98 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.128 -0.942 . . . . 1.77 111.464 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 67' ' ' TRP . 0.7 OUTLIER -78.64 -51.05 10.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.932 0.396 . . . . 2.23 110.829 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.8 t -68.84 -22.93 64.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 1.5900000000000001 111.544 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.7 tttm -53.88 -29.49 41.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.325 -0.398 . . . . 3.5699999999999998 110.766 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 3.4 tp -82.98 -27.1 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 1.6799999999999999 110.848 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.484 ' CE1' ' CD1' ' A' ' 91' ' ' PHE . 10.0 m-85 -71.37 -12.07 61.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.34000000000000002 111.273 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 m -69.96 -30.14 67.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.354 -0.384 . . . . 1.52 111.071 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 m -64.12 -31.78 73.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 1.4399999999999999 110.798 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.7 mt -60.01 -47.2 86.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 2.1499999999999999 110.813 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.414 ' CB ' HD11 ' A' ' 83' ' ' ILE . 9.9 t80 -99.85 63.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 2.6000000000000001 110.841 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.46 -34.21 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.255 -0.429 . . . . 2.3599999999999999 111.223 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -151.03 -54.62 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 3.5800000000000001 110.922 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.2 109.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 2.9399999999999999 111.182 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.414 HD11 ' CB ' ' A' ' 79' ' ' PHE . 1.2 tp -99.4 27.25 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.201 -0.454 . . . . 2.0099999999999998 111.19 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.5 m-20 -57.24 157.95 5.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 2.4700000000000002 110.957 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -47.18 33.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 1.8100000000000001 110.975 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.2 -46.57 62.64 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.745 -0.74 . . . . 0.82999999999999996 112.533 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -71.4 -28.4 63.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.747 0.308 . . . . 3.3399999999999999 110.965 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 78.4 mt -67.34 -31.22 51.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 1.4099999999999999 111.235 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.445 ' HB ' ' CE2' ' A' ' 48' ' ' PHE . 34.5 t -47.4 -43.03 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.414 . . . . 1.49 111.17 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -49.42 -32.88 15.7 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.636 -0.793 . . . . 0.39000000000000001 112.156 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CD1' ' CE1' ' A' ' 75' ' ' PHE . 88.4 t80 -54.22 -58.85 5.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.859 0.361 . . . . 0.46999999999999997 110.812 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PHE . . . . . 0.413 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 29.9 m-85 -73.88 -40.04 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.55000000000000004 110.783 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -55.74 -41.34 73.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 1.3799999999999999 110.88 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.4 -41.76 82.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 1.28 111.007 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.07 -31.28 58.71 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.684 -0.769 . . . . 0.34999999999999998 112.307 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 -80.96 -29.98 35.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.797 0.332 . . . . 2.8199999999999998 110.88 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 97' ' ' TYR . 0.3 OUTLIER -71.93 -35.25 69.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 1.03 110.825 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 36.8 t -85.67 -27.83 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 1.3600000000000001 111.121 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 16.7 m -80.21 -20.84 43.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.269 -0.423 . . . . 2.29 111.212 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -126.28 54.39 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 1.8999999999999999 110.92 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 177.92 -44.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.299 -0.41 . . . . 1.75 111.105 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 15.5 t -107.3 -24.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.299 -0.409 . . . . 1.26 111.425 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 28.1 mt -124.85 107.76 11.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.418 -0.356 . . . . 1.28 111.063 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 18.1 m -60.38 134.75 91.24 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.287 -0.415 . . . . 2.1099999999999999 110.605 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -73.43 -169.99 0.6 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.644 2.229 . . . . 0.64000000000000001 112.357 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 81.59 3.12 90.7 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.684 -0.769 . . . . 0.56000000000000005 112.932 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' SER . . . . . 0.446 ' O ' ' CE1' ' A' ' 112' ' ' HIS . 0.6 OUTLIER -174.43 132.23 0.37 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.875 0.338 . . . . 1.1399999999999999 111.128 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' TRP . . . . . 0.502 ' CH2' ' HB3' ' A' ' 18' ' ' LEU . 36.2 t-105 -88.2 54.92 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.492 . . . . 1.24 110.664 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.5 p -44.86 163.84 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.921 -0.581 . . . . 1.27 110.625 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -47.03 -27.15 1.21 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.383 -0.371 . . . . 2.96 110.932 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 114' ' ' LEU . 12.7 m-20 -61.89 -64.78 0.83 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 1.6599999999999999 111.66 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' HIS . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 108' ' ' TRP . 74.4 m80 -41.89 -38.89 1.66 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.813 0.34 . . . . 0.44 111.391 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.442 ' HG2' ' CD1' ' A' ' 108' ' ' TRP . 14.9 mt-10 -57.8 -40.7 80.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.224 -0.444 . . . . 1.3200000000000001 110.774 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.439 ' HB2' ' CZ3' ' A' ' 67' ' ' TRP . 1.5 mm? -49.23 -38.4 26.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.816 0.341 . . . . 1.9399999999999999 110.59 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.454 ' O ' ' CG ' ' A' ' 119' ' ' MET . 13.4 mt -64.38 -55.41 21.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 1.6299999999999999 110.963 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.75 -40.22 91.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 1.8799999999999999 111.424 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -56.5 -41.35 76.51 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 1.5900000000000001 111.232 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.11 -36.72 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.453 -0.34 . . . . 1.25 111.423 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' MET . . . . . 0.454 ' CG ' ' O ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -45.45 -53.25 9.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 1.3799999999999999 110.825 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 10.6 t -73.83 -44.3 56.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.97999999999999998 111.125 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -48.87 -34.98 13.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.061 0.458 . . . . 3.2200000000000002 109.883 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 16.1 t80 -83.96 -61.1 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 0.88 109.584 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 129' ' ' MET . 1.2 t80 -42.25 -41.6 2.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.576 -0.738 . . . . 1.3500000000000001 110.649 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ILE . . . . . 0.483 ' N ' HD12 ' A' ' 124' ' ' ILE . 0.3 OUTLIER -55.64 -64.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 1.2 110.227 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.58 -20.3 65.54 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.275 -0.639 . . . . 2.0699999999999998 109.275 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 1.044 ' O ' ' N ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -96.74 20.42 10.94 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.005 -0.998 . . . . 2.0899999999999999 110.225 179.16 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -20.43 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.998 1.851 . . . . 2.6200000000000001 115.998 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 1.044 ' N ' ' O ' ' A' ' 126' ' ' ASN . 4.5 pp -45.93 -26.26 0.67 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.978 0.354 . . . . 1.1499999999999999 110.957 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' MET . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 123' ' ' PHE . 5.3 ptp -38.85 -33.68 0.12 Allowed 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.119 -0.491 . . . . 1.6100000000000001 111.346 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -46.0 -28.56 1.19 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 1.6200000000000001 111.29 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -107.0 -21.31 13.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.54 -0.3 . . . . 0.98999999999999999 111.326 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . 0.466 ' CG ' ' HD2' ' A' ' 133' ' ' PRO . 20.4 t80 -44.28 141.15 2.69 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.487 -0.324 . . . . 0.69999999999999996 110.576 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' PRO . . . . . 0.466 ' HD2' ' CG ' ' A' ' 132' ' ' PHE . 73.6 Cg_exo -39.05 94.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.831 2.354 . . . . 0.96999999999999997 112.5 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 13.2 tp -143.99 41.53 1.41 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.049 -0.523 . . . . 2.0699999999999998 110.963 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -125.82 -39.57 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 3.5699999999999998 111.064 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 9.7300000000000004 110.994 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.904 0.383 . . . . 2.0899999999999999 111.157 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.6 -106.47 2.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.867 -0.683 . . . . 0.58999999999999997 112.383 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.467 HG22 ' HB3' ' A' ' 11' ' ' ALA . 6.8 m -85.1 -4.28 59.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.55 0.204 . . . . 0.64000000000000001 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.42 -28.07 18.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.60999999999999999 110.358 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.419 ' CE3' HD23 ' A' ' 13' ' ' LEU . 25.8 m95 -75.61 -15.11 60.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.911 -0.586 . . . . 0.51000000000000001 111.246 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.467 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -67.63 -61.01 2.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.879 0.371 . . . . 0.20000000000000001 110.525 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 29' ' ' CYS . 3.5 m -53.87 -40.24 66.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.497 . . . . 0.69999999999999996 110.446 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.446 ' HB2' HG13 ' A' ' 34' ' ' VAL . 10.3 tp -74.83 -29.55 61.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.35 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.68 HD11 ' CD2' ' A' ' 123' ' ' PHE . 1.1 mt -64.13 -43.57 97.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.39000000000000001 110.712 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.702 HG22 ' HB2' ' A' ' 116' ' ' ASN . 5.2 p -69.19 -29.97 68.06 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.23999999999999999 110.646 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.697 ' HB1' HG21 ' A' ' 38' ' ' VAL . . . -48.35 -64.9 0.67 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.15 -0.477 . . . . 0.19 110.376 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.722 ' CE2' HG21 ' A' ' 45' ' ' THR . 6.0 t80 -57.44 -29.95 64.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.296 0.57 . . . . 0.28999999999999998 109.766 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 15' ' ' THR . 0.0 OUTLIER -64.38 -50.76 66.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.15 -0.932 . . . . 0.25 111.563 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.448 ' HA ' ' CZ3' ' A' ' 108' ' ' TRP . 1.5 mttt -82.24 -41.09 20.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.997 0.427 . . . . 0.71999999999999997 110.831 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -51.96 -25.34 8.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.646 . . . . 0.62 111.59 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 17' ' ' PHE . 24.0 m -93.32 -25.51 4.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.696 0.284 . . . . 0.0 111.35 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.7 t -94.47 16.5 15.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.193 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt 42.26 92.35 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.143 0.497 . . . . 0.0 111.377 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.649 ' O ' HG12 ' A' ' 24' ' ' VAL . 87.0 t -127.21 59.74 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.02 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 45.19 26.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 68.6 96.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.168 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.938 HD21 HG13 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -48.51 120.73 3.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 2.21 110.628 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.43 53.75 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 3.02 111.052 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.603 ' O ' HG23 ' A' ' 12' ' ' THR . 0.7 OUTLIER -147.78 55.75 1.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 1.6100000000000001 110.807 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.938 HG13 HD21 ' A' ' 27' ' ' LEU . 5.1 m -150.24 151.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 1.22 111.244 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.713 ' HB3' HG23 ' A' ' 34' ' ' VAL . 37.5 t70 -71.33 161.49 30.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 2.1600000000000001 110.808 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -28.47 37.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 1.4299999999999999 111.082 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.04 -26.88 15.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.408 -0.36 . . . . 0.5 111.404 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.713 HG23 ' HB3' ' A' ' 31' ' ' ASP . 41.5 t -60.99 -15.46 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.805 0.336 . . . . 0.56999999999999995 110.776 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt -78.06 -48.91 15.03 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.367 -0.379 . . . . 0.94999999999999996 110.576 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 37' ' ' ASP . 1.2 t -57.38 -42.08 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.56999999999999995 110.877 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.405 ' N ' HG12 ' A' ' 36' ' ' VAL . 1.1 m-20 -52.98 -40.77 64.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 1.6100000000000001 110.28 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' ' 16' ' ' ALA . 2.5 t -63.34 -30.64 50.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.5 110.606 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.76 -46.78 57.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 1.02 110.871 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -54.08 31.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.149 -0.478 . . . . 1.48 110.836 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.812 ' O ' HG23 ' A' ' 45' ' ' THR . 82.8 mt -56.0 -41.83 69.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.96999999999999997 110.889 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -44.18 74.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.55000000000000004 111.005 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m -55.02 -41.0 70.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.58999999999999997 111.02 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.68 HD12 ' HA ' ' A' ' 41' ' ' ILE . 2.1 mt -73.59 -35.92 65.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.792 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.812 HG23 ' O ' ' A' ' 41' ' ' ILE . 24.2 p -64.22 -48.76 74.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 0.38 111.066 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.13 -45.45 88.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 2.02 110.896 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.88 -37.43 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 2.25 110.909 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.456 ' CE2' ' HB ' ' A' ' 89' ' ' VAL . 3.5 t80 -66.33 -40.19 89.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 1.55 110.836 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -68.04 -42.73 80.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 3.7200000000000002 110.865 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -68.68 -52.0 35.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 3.7799999999999998 110.823 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -64.54 -65.44 0.67 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 2.77 110.883 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -81.71 97.74 8.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 2.0800000000000001 110.88 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -125.49 -48.36 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 2.5099999999999998 110.89 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.6 t -71.51 -35.66 70.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 2.1200000000000001 110.748 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.7 t -65.31 -21.01 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.106 -0.497 . . . . 1.46 111.215 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -64.62 -15.72 61.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.468 -0.333 . . . . 1.3600000000000001 111.246 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -56.76 -21.16 26.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 4.9000000000000004 110.248 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -39.16 -75.98 0.03 OUTLIER 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.892 -0.595 . . . . 1.4199999999999999 111.5 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.71 49.67 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 2.7400000000000002 111.026 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.9 46.75 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.426 . . . . 1.6899999999999999 110.861 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -147.72 -66.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.742 -0.742 . . . . 0.75 112.479 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -51.25 -39.85 61.72 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.711 2.274 . . . . 1.3600000000000001 112.396 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.09 -28.9 60.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.228 -0.442 . . . . 0.69999999999999996 111.328 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.701 HD13 ' HB3' ' A' ' 67' ' ' TRP . 0.2 OUTLIER -82.71 4.23 25.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 1.6899999999999999 111.502 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.68 -32.92 41.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.481 . . . . 3.1400000000000001 109.972 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -131.47 34.12 3.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.689 -0.687 . . . . 1.3899999999999999 110.342 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.766 ' CZ2' HD11 ' A' ' 103' ' ' LEU . 46.3 p-90 -56.71 -18.69 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.053 -0.522 . . . . 0.46999999999999997 111.575 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HE2' ' CZ2' ' A' ' 67' ' ' TRP . 4.0 mtmt -72.66 -32.42 65.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.307 0.575 . . . . 1.28 109.789 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.39 -5.92 19.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.151 -1.055 . . . . 3.3500000000000001 108.151 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -150.01 62.47 0.98 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.128 -0.942 . . . . 1.77 111.464 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.775 HD12 ' HB2' ' A' ' 118' ' ' CYS . 0.7 OUTLIER -78.64 -51.05 10.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.932 0.396 . . . . 1.6799999999999999 110.829 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.8 t -68.84 -22.93 64.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 1.1299999999999999 111.544 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.7 tttm -53.88 -29.49 41.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.325 -0.398 . . . . 3.0600000000000001 110.766 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.718 ' O ' HD12 ' A' ' 74' ' ' LEU . 3.4 tp -82.98 -27.1 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 1.01 110.848 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.484 ' CE1' ' CD1' ' A' ' 91' ' ' PHE . 10.0 m-85 -71.37 -12.07 61.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.34000000000000002 111.273 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 m -69.96 -30.14 67.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.354 -0.384 . . . . 1.0 111.071 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 m -64.12 -31.78 73.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 1.0900000000000001 110.798 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.7 mt -60.01 -47.2 86.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 1.54 110.813 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.428 ' CB ' HD13 ' A' ' 83' ' ' ILE . 9.9 t80 -99.85 63.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 1.76 110.841 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.46 -34.21 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.255 -0.429 . . . . 2.0099999999999998 111.223 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -151.03 -54.62 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 3.5800000000000001 110.922 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.2 109.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 2.5600000000000001 111.182 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.605 HG23 ' O ' ' A' ' 83' ' ' ILE . 1.2 tp -99.4 27.25 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.201 -0.454 . . . . 1.8200000000000001 111.19 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.5 m-20 -57.24 157.95 5.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 2.1400000000000001 110.957 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -47.18 33.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 1.2 110.975 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.2 -46.57 62.64 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.745 -0.74 . . . . 0.82999999999999996 112.533 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -71.4 -28.4 63.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.747 0.308 . . . . 2.9100000000000001 110.965 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.983 HD13 HD13 ' A' ' 128' ' ' LEU . 78.4 mt -67.34 -31.22 51.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.65000000000000002 111.235 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.456 ' HB ' ' CE2' ' A' ' 48' ' ' PHE . 34.5 t -47.4 -43.03 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.414 . . . . 0.68000000000000005 111.17 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -49.42 -32.88 15.7 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.636 -0.793 . . . . 0.34999999999999998 112.156 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CD1' ' CE1' ' A' ' 75' ' ' PHE . 88.4 t80 -54.22 -58.85 5.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.859 0.361 . . . . 0.40999999999999998 110.812 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PHE . . . . . 0.413 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 29.9 m-85 -73.88 -40.04 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.41999999999999998 110.783 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -55.74 -41.34 73.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 1.3799999999999999 110.88 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.4 -41.76 82.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.40999999999999998 111.007 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.07 -31.28 58.71 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.684 -0.769 . . . . 0.34000000000000002 112.307 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 -80.96 -29.98 35.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.797 0.332 . . . . 2.3100000000000001 110.88 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 97' ' ' TYR . 0.3 OUTLIER -71.93 -35.25 69.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.51000000000000001 110.825 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 36.8 t -85.67 -27.83 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 0.51000000000000001 111.121 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 16.7 m -80.21 -20.84 43.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.269 -0.423 . . . . 1.6299999999999999 111.212 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -126.28 54.39 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 1.8999999999999999 110.92 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 177.92 -44.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.299 -0.41 . . . . 1.72 111.105 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 15.5 t -107.3 -24.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.299 -0.409 . . . . 0.66000000000000003 111.425 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.766 HD11 ' CZ2' ' A' ' 67' ' ' TRP . 28.1 mt -124.85 107.76 11.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.418 -0.356 . . . . 1.22 111.063 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 18.1 m -60.38 134.75 91.24 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.287 -0.415 . . . . 1.55 110.605 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -73.43 -169.99 0.6 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.644 2.229 . . . . 0.58999999999999997 112.357 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 81.59 3.12 90.7 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.684 -0.769 . . . . 0.56000000000000005 112.932 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' SER . . . . . 0.446 ' O ' ' CE1' ' A' ' 112' ' ' HIS . 0.6 OUTLIER -174.43 132.23 0.37 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.875 0.338 . . . . 0.75 111.128 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' TRP . . . . . 0.514 ' CH2' ' HB3' ' A' ' 18' ' ' LEU . 36.2 t-105 -88.2 54.92 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.492 . . . . 1.24 110.664 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.5 p -44.86 163.84 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.921 -0.581 . . . . 0.70999999999999996 110.625 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . 0.498 ' O ' HD22 ' A' ' 114' ' ' LEU . 6.6 mt-10 -47.03 -27.15 1.21 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.383 -0.371 . . . . 2.96 110.932 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . 0.699 ' HA ' HD23 ' A' ' 114' ' ' LEU . 12.7 m-20 -61.89 -64.78 0.83 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 1.6599999999999999 111.66 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' HIS . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 108' ' ' TRP . 74.4 m80 -41.89 -38.89 1.66 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.813 0.34 . . . . 0.35999999999999999 111.391 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.458 ' HG2' ' CD1' ' A' ' 108' ' ' TRP . 14.9 mt-10 -57.8 -40.7 80.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.224 -0.444 . . . . 1.3200000000000001 110.774 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.699 HD23 ' HA ' ' A' ' 111' ' ' ASP . 1.5 mm? -49.23 -38.4 26.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.816 0.341 . . . . 1.26 110.59 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.548 ' HB2' HD21 ' A' ' 18' ' ' LEU . 13.4 mt -64.38 -55.41 21.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 1.0900000000000001 110.963 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.702 ' HB2' HG22 ' A' ' 15' ' ' THR . 0.0 OUTLIER -65.75 -40.22 91.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 1.1899999999999999 111.424 -179.633 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -56.5 -41.35 76.51 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 1.5900000000000001 111.232 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.775 ' HB2' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -92.11 -36.72 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.453 -0.34 . . . . 0.56000000000000005 111.423 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 119' ' ' MET . . . . . 0.503 ' CE ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -45.45 -53.25 9.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.55000000000000004 110.825 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.471 HG23 ' N ' ' A' ' 121' ' ' HIS . 10.6 t -73.83 -44.3 56.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.29999999999999999 111.125 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' HIS . . . . . 0.471 ' N ' HG23 ' A' ' 120' ' ' THR . 20.5 t-80 -48.87 -34.98 13.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.061 0.458 . . . . 2.3199999999999998 109.883 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 16.1 t80 -83.96 -61.1 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 0.72999999999999998 109.584 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' PHE . . . . . 0.68 ' CD2' HD11 ' A' ' 14' ' ' ILE . 1.2 t80 -42.25 -41.6 2.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.576 -0.738 . . . . 0.80000000000000004 110.649 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ILE . . . . . 0.54 HD13 ' N ' ' A' ' 124' ' ' ILE . 0.3 OUTLIER -55.64 -64.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.38 110.227 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.58 -20.3 65.54 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.275 -0.639 . . . . 2.0699999999999998 109.275 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASN . . . . . 1.044 ' O ' ' N ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -96.74 20.42 10.94 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.005 -0.998 . . . . 1.6899999999999999 110.225 179.16 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASN . . . . . 0.415 ' HA ' ' CE ' ' A' ' 129' ' ' MET . 3.8 m-20 -20.43 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.998 1.851 . . . . 2.3100000000000001 115.998 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 1.044 ' N ' ' O ' ' A' ' 126' ' ' ASN . 4.5 pp -45.93 -26.26 0.67 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.978 0.354 . . . . 0.56000000000000005 110.957 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' MET . . . . . 0.632 ' N ' HD12 ' A' ' 128' ' ' LEU . 5.3 ptp -38.85 -33.68 0.12 Allowed 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.119 -0.491 . . . . 0.96999999999999997 111.346 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -46.0 -28.56 1.19 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 1.2 111.29 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -107.0 -21.31 13.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.54 -0.3 . . . . 0.98999999999999999 111.326 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.553 ' HD2' HG21 ' A' ' 88' ' ' ILE . 20.4 t80 -44.28 141.15 2.69 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.487 -0.324 . . . . 0.39000000000000001 110.576 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' PRO . . . . . 0.471 ' HD2' ' CG ' ' A' ' 132' ' ' PHE . 73.6 Cg_exo -39.05 94.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.831 2.354 . . . . 0.76000000000000001 112.5 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 13.2 tp -143.99 41.53 1.41 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.049 -0.523 . . . . 1.3600000000000001 110.963 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -125.82 -39.57 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 3.5699999999999998 111.064 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 9.7300000000000004 110.994 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.904 0.383 . . . . 2.09 111.157 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 104.6 -106.47 2.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.867 -0.683 . . . . 0.59 112.383 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.467 HG22 ' HB3' ' A' ' 11' ' ' ALA . 6.8 m -85.1 -4.28 59.1 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.55 0.204 . . . . 0.64 111.55 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.42 -28.07 18.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.987 0.422 . . . . 0.61 110.358 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.419 ' CE3' HD23 ' A' ' 13' ' ' LEU . 25.8 m95 -75.61 -15.11 60.39 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.911 -0.586 . . . . 0.51 111.246 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.467 ' HB3' HG22 ' A' ' 8' ' ' THR . . . -67.63 -61.01 2.09 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.879 0.371 . . . . 0.2 110.525 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 29' ' ' CYS . 3.5 m -53.87 -40.24 66.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.108 -0.497 . . . . 0.7 110.446 179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.446 ' HB2' HG13 ' A' ' 34' ' ' VAL . 10.3 tp -74.83 -29.55 61.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.35 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.68 HD11 ' CD2' ' A' ' 123' ' ' PHE . 1.1 mt -64.13 -43.57 97.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.39 110.712 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.702 HG22 ' HB2' ' A' ' 116' ' ' ASN . 5.2 p -69.19 -29.97 68.06 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.301 -0.409 . . . . 0.24 110.646 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.697 ' HB1' HG21 ' A' ' 38' ' ' VAL . . . -48.35 -64.9 0.67 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.15 -0.477 . . . . 0.19 110.376 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.722 ' CE2' HG21 ' A' ' 45' ' ' THR . 6.0 t80 -57.44 -29.95 64.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.296 0.57 . . . . 0.29 109.766 178.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.611 ' HB2' ' HA ' ' A' ' 15' ' ' THR . 0.0 OUTLIER -64.38 -50.76 66.39 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.15 -0.932 . . . . 0.25 111.563 -179.845 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.448 ' HA ' ' CZ3' ' A' ' 108' ' ' TRP . 1.5 mttt -82.24 -41.09 20.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.997 0.427 . . . . 0.72 110.831 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.4 m -51.96 -25.34 8.04 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.778 -0.646 . . . . 0.62 111.59 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 17' ' ' PHE . 24.0 m -93.32 -25.51 4.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.696 0.284 . . . . 0.0 111.35 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.7 t -94.47 16.5 15.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.193 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt 42.26 92.35 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.143 0.497 . . . . 0.0 111.377 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.649 ' O ' HG12 ' A' ' 24' ' ' VAL . 87.0 t -127.21 59.74 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.02 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 45.19 26.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.276 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 68.6 96.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.168 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.938 HD21 HG13 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -48.51 120.73 3.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.09 -0.505 . . . . 2.21 110.628 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -98.43 53.75 1.05 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 3.02 111.052 -179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.603 ' O ' HG23 ' A' ' 12' ' ' THR . 0.7 OUTLIER -147.78 55.75 1.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 1.61 110.807 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.938 HG13 HD21 ' A' ' 27' ' ' LEU . 5.1 m -150.24 151.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.445 . . . . 1.22 111.244 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.713 ' HB3' HG23 ' A' ' 34' ' ' VAL . 37.5 t70 -71.33 161.49 30.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 2.16 110.808 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.95 -28.47 37.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 1.43 111.082 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -95.04 -26.88 15.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.408 -0.36 . . . . 0.5 111.404 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.713 HG23 ' HB3' ' A' ' 31' ' ' ASP . 41.5 t -60.99 -15.46 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.805 0.336 . . . . 0.57 110.776 179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mt -78.06 -48.91 15.03 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.367 -0.379 . . . . 0.95 110.576 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 37' ' ' ASP . 1.2 t -57.38 -42.08 79.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.008 -0.542 . . . . 0.57 110.877 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.405 ' N ' HG12 ' A' ' 36' ' ' VAL . 1.1 m-20 -52.98 -40.77 64.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 1.61 110.28 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' ' 16' ' ' ALA . 2.5 t -63.34 -30.64 50.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.956 -0.566 . . . . 0.5 110.606 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.76 -46.78 57.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 1.02 110.871 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.79 -54.08 31.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.149 -0.478 . . . . 1.48 110.836 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.812 ' O ' HG23 ' A' ' 45' ' ' THR . 82.8 mt -56.0 -41.83 69.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.18 -0.464 . . . . 0.97 110.889 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.33 -44.18 74.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.55 111.005 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.2 m -55.02 -41.0 70.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.59 111.02 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.68 HD12 ' HA ' ' A' ' 41' ' ' ILE . 2.1 mt -73.59 -35.92 65.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 1.23 110.792 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.812 HG23 ' O ' ' A' ' 41' ' ' ILE . 24.2 p -64.22 -48.76 74.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.169 -0.469 . . . . 0.38 111.066 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -64.13 -45.45 88.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.188 -0.46 . . . . 2.02 110.896 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -62.88 -37.43 86.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 2.25 110.909 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.456 ' CE2' ' HB ' ' A' ' 89' ' ' VAL . 3.5 t80 -66.33 -40.19 89.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 1.55 110.836 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -68.04 -42.73 80.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 3.72 110.865 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -68.68 -52.0 35.77 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.15 -0.477 . . . . 3.78 110.823 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -64.54 -65.44 0.67 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.185 -0.461 . . . . 2.77 110.883 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 98.9 m-85 -81.71 97.74 8.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 2.08 110.88 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -125.49 -48.36 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 2.51 110.89 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.6 t -71.51 -35.66 70.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.235 -0.439 . . . . 2.12 110.748 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 6.7 t -65.31 -21.01 28.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.106 -0.497 . . . . 1.46 111.215 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.3 m-30 -64.62 -15.72 61.61 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.468 -0.333 . . . . 1.36 111.246 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -56.76 -21.16 26.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.814 0.34 . . . . 4.9 110.248 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -39.16 -75.98 0.03 OUTLIER 'General case' 0 C--O 1.231 0.106 0 CA-C-N 115.892 -0.595 . . . . 1.42 111.5 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.71 49.67 0.42 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.27 -0.423 . . . . 2.74 111.026 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.9 46.75 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.264 -0.426 . . . . 1.69 110.861 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -147.72 -66.83 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.742 -0.742 . . . . 0.75 112.479 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -51.25 -39.85 61.72 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.711 2.274 . . . . 1.36 112.396 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.09 -28.9 60.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.228 -0.442 . . . . 0.7 111.328 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.701 HD13 ' HB3' ' A' ' 67' ' ' TRP . 0.2 OUTLIER -82.71 4.23 25.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 1.69 111.502 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.68 -32.92 41.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.481 . . . . 3.14 109.972 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -131.47 34.12 3.98 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.689 -0.687 . . . . 1.39 110.342 179.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.766 ' CZ2' HD11 ' A' ' 103' ' ' LEU . 46.3 p-90 -56.71 -18.69 13.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.053 -0.522 . . . . 0.47 111.575 -179.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.418 ' HE2' ' CZ2' ' A' ' 67' ' ' TRP . 4.0 mtmt -72.66 -32.42 65.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.307 0.575 . . . . 1.28 109.789 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.39 -5.92 19.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 108.151 -1.055 . . . . 3.35 108.151 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -150.01 62.47 0.98 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.128 -0.942 . . . . 1.77 111.464 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.775 HD12 ' HB2' ' A' ' 118' ' ' CYS . 0.7 OUTLIER -78.64 -51.05 10.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.932 0.396 . . . . 1.68 110.829 179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 28.8 t -68.84 -22.93 64.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 1.13 111.544 -179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.7 tttm -53.88 -29.49 41.8 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.325 -0.398 . . . . 3.06 110.766 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.718 ' O ' HD12 ' A' ' 74' ' ' LEU . 3.4 tp -82.98 -27.1 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.081 -0.509 . . . . 1.01 110.848 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.484 ' CE1' ' CD1' ' A' ' 91' ' ' PHE . 10.0 m-85 -71.37 -12.07 61.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.34 111.273 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 2.1 m -69.96 -30.14 67.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.354 -0.384 . . . . 1.0 111.071 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 m -64.12 -31.78 73.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.196 -0.456 . . . . 1.09 110.798 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 20.7 mt -60.01 -47.2 86.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.103 -0.499 . . . . 1.54 110.813 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.428 ' CB ' HD13 ' A' ' 83' ' ' ILE . 9.9 t80 -99.85 63.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.156 -0.475 . . . . 1.76 110.841 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 4.4 p -113.46 -34.21 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.255 -0.429 . . . . 2.01 111.223 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -151.03 -54.62 0.14 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 3.58 110.922 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -121.2 109.52 25.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 2.56 111.182 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.605 ' O ' HG23 ' A' ' 83' ' ' ILE . 1.2 tp -99.4 27.25 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.201 -0.454 . . . . 1.82 111.19 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.5 m-20 -57.24 157.95 5.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.219 -0.446 . . . . 2.14 110.957 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -48.03 -47.18 33.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.185 -0.461 . . . . 1.2 110.975 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -53.2 -46.57 62.64 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.745 -0.74 . . . . 0.83 112.533 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -71.4 -28.4 63.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.747 0.308 . . . . 2.91 110.965 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.983 HD13 HD13 ' A' ' 128' ' ' LEU . 78.4 mt -67.34 -31.22 51.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.65 111.235 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.456 ' HB ' ' CE2' ' A' ' 48' ' ' PHE . 34.5 t -47.4 -43.03 8.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.288 -0.414 . . . . 0.68 111.17 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -49.42 -32.88 15.7 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.636 -0.793 . . . . 0.35 112.156 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CD1' ' CE1' ' A' ' 75' ' ' PHE . 88.4 t80 -54.22 -58.85 5.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.859 0.361 . . . . 0.41 110.812 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PHE . . . . . 0.413 ' O ' ' CE1' ' A' ' 17' ' ' PHE . 29.9 m-85 -73.88 -40.04 63.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.42 110.783 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -55.74 -41.34 73.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 1.38 110.88 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 2.3 t -58.4 -41.76 82.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.41 111.007 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -56.07 -31.28 58.71 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.684 -0.769 . . . . 0.34 112.307 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 -80.96 -29.98 35.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.797 0.332 . . . . 2.31 110.88 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 97' ' ' TYR . 0.3 OUTLIER -71.93 -35.25 69.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.434 . . . . 0.51 110.825 179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 36.8 t -85.67 -27.83 6.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.243 -0.435 . . . . 0.51 111.121 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 16.7 m -80.21 -20.84 43.77 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.269 -0.423 . . . . 1.63 111.212 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -126.28 54.39 1.56 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.446 -0.343 . . . . 1.9 110.92 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 177.92 -44.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.299 -0.41 . . . . 1.72 111.105 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 15.5 t -107.3 -24.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.299 -0.409 . . . . 0.66 111.425 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.766 HD11 ' CZ2' ' A' ' 67' ' ' TRP . 28.1 mt -124.85 107.76 11.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.418 -0.356 . . . . 1.22 111.063 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 18.1 m -60.38 134.75 91.24 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.287 -0.415 . . . . 1.55 110.605 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -73.43 -169.99 0.6 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.644 2.229 . . . . 0.59 112.357 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 81.59 3.12 90.7 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.684 -0.769 . . . . 0.56 112.932 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' SER . . . . . 0.446 ' O ' ' CE1' ' A' ' 112' ' ' HIS . 0.6 OUTLIER -174.43 132.23 0.37 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.875 0.338 . . . . 0.75 111.128 -179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' TRP . . . . . 0.514 ' CH2' ' HB3' ' A' ' 18' ' ' LEU . 36.2 t-105 -88.2 54.92 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.492 . . . . 1.24 110.664 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 24.5 p -44.86 163.84 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.921 -0.581 . . . . 0.71 110.625 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . 0.498 ' O ' HD22 ' A' ' 114' ' ' LEU . 6.6 mt-10 -47.03 -27.15 1.21 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.383 -0.371 . . . . 2.96 110.932 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.699 ' HA ' HD23 ' A' ' 114' ' ' LEU . 12.7 m-20 -61.89 -64.78 0.83 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.258 -0.428 . . . . 1.66 111.66 -179.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' HIS . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 108' ' ' TRP . 74.4 m80 -41.89 -38.89 1.66 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.813 0.34 . . . . 0.36 111.391 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.458 ' HG2' ' CD1' ' A' ' 108' ' ' TRP . 14.9 mt-10 -57.8 -40.7 80.52 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.224 -0.444 . . . . 1.32 110.774 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.699 HD23 ' HA ' ' A' ' 111' ' ' ASP . 1.5 mm? -49.23 -38.4 26.44 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.816 0.341 . . . . 1.26 110.59 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.548 ' HB2' HD21 ' A' ' 18' ' ' LEU . 13.4 mt -64.38 -55.41 21.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.157 -0.474 . . . . 1.09 110.963 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.702 ' HB2' HG22 ' A' ' 15' ' ' THR . 0.0 OUTLIER -65.75 -40.22 91.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.171 -0.468 . . . . 1.19 111.424 -179.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -56.5 -41.35 76.51 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.305 -0.407 . . . . 1.59 111.232 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.775 ' HB2' HD12 ' A' ' 71' ' ' LEU . 0.8 OUTLIER -92.11 -36.72 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.453 -0.34 . . . . 0.56 111.423 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' MET . . . . . 0.503 ' CE ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -45.45 -53.25 9.05 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.807 0.337 . . . . 0.55 110.825 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.471 HG23 ' N ' ' A' ' 121' ' ' HIS . 10.6 t -73.83 -44.3 56.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.287 -0.415 . . . . 0.3 111.125 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' HIS . . . . . 0.471 ' N ' HG23 ' A' ' 120' ' ' THR . 20.5 t-80 -48.87 -34.98 13.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.061 0.458 . . . . 2.32 109.883 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' PHE . . . . . 0.452 ' O ' ' HB2' ' A' ' 126' ' ' ASN . 16.1 t80 -83.96 -61.1 1.91 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.7 -0.682 . . . . 0.73 109.584 178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' PHE . . . . . 0.68 ' CD2' HD11 ' A' ' 14' ' ' ILE . 1.2 t80 -42.25 -41.6 2.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.576 -0.738 . . . . 0.8 110.649 178.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ILE . . . . . 0.54 ' N ' HD13 ' A' ' 124' ' ' ILE . 0.3 OUTLIER -55.64 -64.28 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.961 -0.563 . . . . 0.38 110.227 179.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -63.58 -20.3 65.54 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.275 -0.639 . . . . 2.07 109.275 178.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 1.044 ' O ' ' N ' ' A' ' 128' ' ' LEU . 0.3 OUTLIER -96.74 20.42 10.94 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 115.005 -0.998 . . . . 1.69 110.225 179.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASN . . . . . 0.415 ' HA ' ' CE ' ' A' ' 129' ' ' MET . 3.8 m-20 -20.43 5.08 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.998 1.851 . . . . 2.31 115.998 -178.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 1.044 ' N ' ' O ' ' A' ' 126' ' ' ASN . 4.5 pp -45.93 -26.26 0.67 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 117.978 0.354 . . . . 0.56 110.957 178.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . 0.632 ' N ' HD12 ' A' ' 128' ' ' LEU . 5.3 ptp -38.85 -33.68 0.12 Allowed 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.119 -0.491 . . . . 0.97 111.346 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -46.0 -28.56 1.19 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.096 -0.502 . . . . 1.2 111.29 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -107.0 -21.31 13.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.54 -0.3 . . . . 0.99 111.326 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.553 ' HD2' HG21 ' A' ' 88' ' ' ILE . 20.4 t80 -44.28 141.15 2.69 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.487 -0.324 . . . . 0.39 110.576 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' PRO . . . . . 0.471 ' HD2' ' CG ' ' A' ' 132' ' ' PHE . 73.6 Cg_exo -39.05 94.8 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.831 2.354 . . . . 0.76 112.5 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 13.2 tp -143.99 41.53 1.41 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.049 -0.523 . . . . 1.36 110.963 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -125.82 -39.57 2.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 3.57 111.064 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.183 -0.462 . . . . 9.73 110.994 -179.981 . . . . . . . . 1 1 . 1 stop_ save_