data_1h8m_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 1h8m _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.49 ' HA ' ' HB2' ' A' ' 84' ' ' GLN . 19.8 mtp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.61 0.226 . . . . 4.6699999999999999 111.61 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -156.55 155.47 31.97 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.82 0.343 . . . . 3.25 111.418 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.61 ' CG2' ' HA ' ' A' ' 133' ' ' GLN . 17.2 tt -66.93 133.86 30.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.079 -0.51 . . . . 1.26 109.934 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -106.45 -26.08 11.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.288 0.847 . . . . 2.8700000000000001 113.288 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.596 ' CD2' ' HB3' ' A' ' 40' ' ' MET . 21.4 t80 -152.6 147.86 26.66 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 113.101 0.778 . . . . 1.97 113.101 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.735 ' HB ' HG13 ' A' ' 129' ' ' ILE . 0.8 OUTLIER -142.14 162.25 19.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.66 -1.155 . . . . 1.1799999999999999 108.692 177.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.624 ' HA3' ' CD1' ' A' ' 125' ' ' LEU . . . 164.56 -164.05 36.59 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 119.617 -1.278 . . . . 0.38 113.364 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.777 ' HB ' ' HB3' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -151.04 143.02 16.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.847 -0.676 . . . . 1.1200000000000001 109.55 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.646 ' CE1' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -157.01 124.91 5.48 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.793 0.33 . . . . 2.21 111.554 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.617 ' HB2' ' HB ' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -77.38 134.28 38.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 3.4700000000000002 110.017 178.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.1 100.16 0.57 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.832 0.349 . . . . 1.48 110.903 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.1 -114.13 0.85 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 121.035 -0.602 . . . . 1.8300000000000001 112.478 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -110.37 -95.26 2.32 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.081 -0.58 . . . . 1.51 112.379 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -67.37 -33.81 75.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.631 0.253 . . . . 3.3300000000000001 111.092 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.94 -175.74 4.01 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 3.0 110.203 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.423 ' HB3' ' N ' ' A' ' 49' ' ' SER . . . -97.08 129.68 44.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.73 0.3 . . . . 1.22 111.489 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.5 102.42 0.42 Allowed 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.006 -0.543 . . . . 2.2799999999999998 109.839 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -49.77 104.16 0.06 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.999 -0.546 . . . . 3.25 112.354 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.777 ' HB3' ' HB ' ' A' ' 8' ' ' VAL . 2.1 tp -78.19 -51.85 9.57 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.783 -0.644 . . . . 2.1800000000000002 110.03 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.439 ' OG ' HG21 ' A' ' 8' ' ' VAL . 13.4 p -156.19 147.69 22.68 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.797 -0.638 . . . . 1.8899999999999999 109.742 178.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -134.12 113.17 11.78 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.421 0.897 . . . . 2.5 113.421 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.582 ' CG1' HG22 ' A' ' 129' ' ' ILE . 12.0 p -120.82 136.23 58.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.533 -0.758 . . . . 1.22 109.352 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.476 ' HG3' ' CD2' ' A' ' 5' ' ' TYR . 0.9 OUTLIER -125.66 158.4 34.84 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 113.124 0.787 . . . . 2.6200000000000001 113.124 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.569 ' HB2' HD12 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -126.94 106.57 9.39 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.475 -1.239 . . . . 1.6000000000000001 107.96 176.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.549 ' HA ' ' CD2' ' A' ' 28' ' ' PHE . 4.2 mt -114.02 74.1 0.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.276 0.56 . . . . 2.2000000000000002 110.931 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.2 m -90.71 -51.53 5.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.428 -0.805 . . . . 2.2400000000000002 111.752 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -82.48 -19.1 39.49 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.462 0.542 . . . . 2.8799999999999999 112.462 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.549 ' CD2' ' HA ' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -87.73 127.34 35.31 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.624 0.249 . . . . 2.3599999999999999 110.798 -179.548 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.71 -175.37 4.5 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.357 -0.449 . . . . 2.0 113.494 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.405 ' HA ' ' HD3' ' A' ' 33' ' ' ARG . 53.8 p90 -58.91 -36.62 75.01 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 111.65 0.241 . . . . 4.25 111.65 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -90.6 -36.86 14.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.607 -0.27 . . . . 4.2000000000000002 110.99 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -67.0 -46.04 75.75 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 116.309 -0.405 . . . . 2.6899999999999999 111.027 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.485 ' HB2' ' CD1' ' A' ' 25' ' ' LEU . 9.4 ptm180 -49.31 -35.58 18.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 3.6899999999999999 111.675 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.4 t -64.94 -52.59 55.53 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.781 0.324 . . . . 1.3700000000000001 110.529 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.8 m -62.72 -45.34 93.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.047 -0.524 . . . . 1.9399999999999999 110.95 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.96 -37.26 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 116.573 -0.285 . . . . 1.29 110.822 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.22 -45.72 92.39 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.863 -0.895 . . . . 0.65000000000000002 110.863 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -60.6 -39.96 90.05 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 108.953 -0.758 . . . . 2.8100000000000001 108.953 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.419 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 0.3 OUTLIER -58.72 -45.71 88.96 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 115.609 -0.723 . . . . 2.73 110.234 178.358 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.596 ' HB3' ' CD2' ' A' ' 5' ' ' TYR . 24.6 mtt -60.21 -59.52 5.28 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.603 -0.726 . . . . 2.1200000000000001 112.286 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.31 -56.0 26.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.584 -0.28 . . . . 1.24 111.73 -179.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.504 ' HA ' ' HG2' ' A' ' 45' ' ' GLU . 14.3 t80 -50.92 -37.85 46.56 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.92 0.39 . . . . 2.4300000000000002 110.957 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.426 ' O ' HG23 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -74.75 -37.57 62.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 2.5 110.289 178.808 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.635 ' HA ' HG12 ' A' ' 78' ' ' VAL . . . -69.21 -35.69 76.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.18 -0.464 . . . . 1.05 111.312 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 42' ' ' PHE . 9.5 pt-20 -73.29 -34.02 65.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.122 -0.695 . . . . 1.28 109.122 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.431 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 1.2 m -65.19 -49.38 70.0 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.101 -0.5 . . . . 1.23 109.901 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.735 ' HB ' ' CG2' ' A' ' 68' ' ' VAL . 0.1 OUTLIER -55.29 -55.65 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 O-C-N 123.029 0.206 . . . . 1.26 110.845 179.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.579 ' CB ' ' HB2' ' A' ' 9' ' ' PHE . . . -55.78 -29.96 60.52 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.355 -0.609 . . . . 1.1399999999999999 109.355 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.423 ' N ' ' HB3' ' A' ' 16' ' ' ALA . 7.5 t -72.27 -45.97 57.87 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.045 -0.525 . . . . 1.3999999999999999 109.889 177.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.654 ' CG ' ' HA ' ' A' ' 47' ' ' VAL . 2.1 ptp180 -74.46 -17.91 60.71 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 116.666 -0.243 . . . . 2.46 111.019 178.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.457 ' OG1' HG12 ' A' ' 68' ' ' VAL . 51.7 m -88.71 106.61 18.46 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.372 -0.973 . . . . 1.3200000000000001 108.372 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.87 36.91 2.31 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 114.869 0.707 . . . . 1.0600000000000001 114.869 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.645 ' HA ' ' HB3' ' A' ' 70' ' ' ALA . . . 63.46 140.54 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 117.389 0.594 . . . . 1.4299999999999999 112.41 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.39 4.62 80.28 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.986 -0.626 . . . . 1.0700000000000001 112.334 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.54 165.26 25.61 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.915 0.388 . . . . 2.6600000000000001 111.355 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -114.09 151.4 32.61 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.954 -0.566 . . . . 3.6400000000000001 110.772 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.549 ' O ' ' HB ' ' A' ' 68' ' ' VAL . 8.8 mm-40 -137.89 124.81 21.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 2.1600000000000001 112.112 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -117.8 102.01 8.77 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 107.714 -1.217 . . . . 1.97 107.714 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.729 HG13 ' HA2' ' A' ' 66' ' ' GLY . 0.1 OUTLIER -86.05 108.56 17.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.724 -0.671 . . . . 1.3300000000000001 111.787 -177.818 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.2 108.27 16.99 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.521 -0.763 . . . . 2.6299999999999999 110.371 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -108.95 163.63 13.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.865 -0.607 . . . . 2.0699999999999998 110.638 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -78.28 54.68 3.97 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 120.952 -0.642 . . . . 1.9399999999999999 112.092 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -179.73 -42.59 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.723 0.409 . . . . 4.1200000000000001 110.532 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -158.23 178.53 10.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.199 0.524 . . . . 2.9900000000000002 111.705 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.549 HG23 ' CE1' ' A' ' 67' ' ' HIS . 3.2 mt -108.3 160.88 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.44 -0.8 . . . . 1.4299999999999999 110.548 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.729 ' HA2' HG13 ' A' ' 59' ' ' ILE . . . -132.2 78.23 0.37 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.754 -0.736 . . . . 0.65000000000000002 111.961 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.549 ' CE1' HG23 ' A' ' 65' ' ' ILE . 73.4 m-70 -61.44 149.96 36.97 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.911 0.386 . . . . 0.89000000000000001 111.242 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.735 ' CG2' ' HB ' ' A' ' 47' ' ' VAL . 2.1 t -145.08 141.1 22.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.184 -0.462 . . . . 1.26 111.022 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.582 ' HB2' ' CG ' ' A' ' 94' ' ' LEU . 83.8 m-85 -141.02 111.38 6.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.816 -0.629 . . . . 2.73 109.777 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.645 ' HB3' ' HA ' ' A' ' 53' ' ' ALA . . . -98.28 155.11 17.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.039 -0.528 . . . . 1.23 112.266 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 176.68 5.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.542 -0.754 . . . . 4.6200000000000001 110.747 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 t -98.57 36.35 1.65 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.416 -0.356 . . . . 2.52 111.327 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -122.58 -40.53 2.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.44 -0.346 . . . . 4.6200000000000001 111.57 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 142.42 -22.23 2.39 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 121.263 -0.494 . . . . 1.3999999999999999 112.593 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.617 ' HB ' ' HB2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -108.13 118.77 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 109.469 -0.567 . . . . 1.47 109.469 179.462 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . 0.423 ' CB ' ' HA ' ' A' ' 70' ' ' ALA . 26.5 p -108.79 165.9 11.21 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.129 -0.487 . . . . 1.6299999999999999 112.193 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.636 ' HA3' ' HA ' ' A' ' 8' ' ' VAL . . . -118.03 149.93 18.34 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 115.747 -0.66 . . . . 0.54000000000000004 111.487 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.646 ' HB ' ' CE1' ' A' ' 9' ' ' PHE . 2.6 t -118.23 144.84 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 120.11 -0.636 . . . . 1.23 112.619 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.596 ' CD1' ' HB3' ' A' ' 93' ' ' LEU . 0.3 OUTLIER -134.25 99.29 4.35 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.233 -0.894 . . . . 2.25 110.767 -179.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.621 ' CG2' ' HA3' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -99.83 117.77 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.886 0.374 . . . . 1.47 111.943 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.562 ' HB ' HG13 ' A' ' 3' ' ' ILE . 4.3 t -140.51 167.72 21.49 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.22 -0.445 . . . . 1.21 111.546 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.82 160.49 20.19 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.35 -0.386 . . . . 1.6699999999999999 111.057 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -21.3 61.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.194 -0.457 . . . . 3.7999999999999998 111.195 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.49 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 7.1 mm-40 -86.49 26.53 1.07 Allowed 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.016 0.436 . . . . 3.5499999999999998 111.294 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TYR . . . . . 0.499 ' HB3' HG22 ' A' ' 81' ' ' THR . 0.5 OUTLIER -135.6 91.16 18.59 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 106.683 -1.599 . . . . 2.4199999999999999 106.683 178.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -47.53 161.29 0.3 Allowed 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 123.307 2.671 . . . . 1.4099999999999999 114.048 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.419 HG21 ' CE1' ' A' ' 67' ' ' HIS . 1.7 t -75.36 -26.41 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 2.0 111.625 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.467 ' HB2' ' HD3' ' A' ' 89' ' ' PRO . 2.2 mmm-85 -55.77 -56.07 33.97 Favored Pre-proline 0 N--CA 1.466 0.364 0 N-CA-C 111.518 0.192 . . . . 3.4199999999999999 111.518 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.467 ' HD3' ' HB2' ' A' ' 88' ' ' ARG . 39.7 Cg_endo -65.52 -29.86 52.61 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.752 1.635 . . . . 1.24 111.039 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -68.51 -29.99 68.71 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.904 -1.147 . . . . 1.3400000000000001 107.904 176.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.498 ' O ' ' HB2' ' A' ' 95' ' ' ASN . 1.0 OUTLIER -67.45 -47.05 71.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.152 -1.055 . . . . 2.5699999999999998 108.152 177.005 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.3 m -61.32 -43.35 99.02 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 115.751 -0.659 . . . . 1.3300000000000001 110.504 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.596 ' HB3' ' CD1' ' A' ' 79' ' ' LEU . 3.3 tt -65.17 -51.77 59.05 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.987 -0.551 . . . . 1.9299999999999999 110.732 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.709 ' HA ' ' CG2' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -68.8 -9.1 49.13 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.389 -0.369 . . . . 2.9700000000000002 110.252 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 5.8 t-20 -76.93 -52.67 9.0 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 109.417 -0.586 . . . . 2.0 109.417 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 100' ' ' GLU . 1.3 mptp? -67.29 -37.71 83.84 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.542 -0.754 . . . . 3.0099999999999998 110.948 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.709 ' CG2' ' HA ' ' A' ' 94' ' ' LEU . 6.4 tt -62.76 -53.78 42.45 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 N-CA-C 112.15 0.426 . . . . 1.5700000000000001 112.15 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.518 ' N ' ' CG2' ' A' ' 97' ' ' ILE . 0.4 OUTLIER -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.908 -0.317 . . . . 2.0600000000000001 110.492 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.405 ' HA ' ' HG ' ' A' ' 102' ' ' LEU . 4.5 m-20 -67.52 -30.62 70.33 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.532 -0.544 . . . . 1.6599999999999999 109.532 178.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.686 ' HB3' ' HE2' ' A' ' 122' ' ' MET . 10.3 tp10 -69.49 -37.57 77.29 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.186 -0.915 . . . . 1.8200000000000001 109.829 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' TYR . . . . . 0.49 ' CE2' HD23 ' A' ' 19' ' ' LEU . 26.8 t80 -65.4 -34.55 78.56 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.719 -0.475 . . . . 2.2400000000000002 109.719 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -72.49 -26.52 61.82 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.695 -0.229 . . . . 2.1299999999999999 111.268 179.133 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -80.97 -51.19 15.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.554 0.575 . . . . 1.6799999999999999 112.554 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -44.93 -25.46 0.31 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.083 0.468 . . . . 1.3799999999999999 110.59 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.592 ' CD2' ' N ' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -168.45 131.36 1.26 Allowed Pre-proline 0 N--CA 1.45 -0.437 0 CA-C-N 115.339 -0.846 . . . . 1.1699999999999999 109.425 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -33.0 149.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 124.069 3.179 . . . . 1.3400000000000001 114.5 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.739 ' HA ' ' CZ2' ' A' ' 110' ' ' TRP . 0.5 OUTLIER -47.14 -49.96 21.27 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.297 -0.865 . . . . 3.8100000000000001 112.423 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -75.24 -26.53 58.93 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.27 0.47 . . . . 2.9300000000000002 112.27 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.572 ' HG2' ' HB2' ' A' ' 105' ' ' HIS . 0.6 OUTLIER -45.67 -43.11 12.32 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.698 0.285 . . . . 1.95 111.176 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' TRP . . . . . 0.739 ' CZ2' ' HA ' ' A' ' 107' ' ' LYS . 0.5 OUTLIER -95.67 -51.28 4.58 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.243 -0.435 . . . . 1.1200000000000001 110.246 179.097 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . 0.611 ' O ' ' HB2' ' A' ' 112' ' ' ASP . . . 37.24 55.52 1.33 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.669 -0.696 . . . . 1.5800000000000001 111.753 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.611 ' HB2' ' O ' ' A' ' 111' ' ' ALA . 2.0 m-20 100.86 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.801 1.24 . . . . 2.25 110.685 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.646 HG21 ' HB2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER 59.45 104.85 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.244 -0.434 . . . . 1.97 111.741 178.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 32.6 p -81.58 10.12 6.48 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.895 -0.593 . . . . 2.3799999999999999 110.126 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -161.94 96.96 1.03 Allowed 'General case' 0 C--N 1.347 0.494 0 N-CA-C 112.119 0.415 . . . . 2.1299999999999999 112.119 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.548 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -145.9 172.91 12.66 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.31 -0.404 . . . . 2.3900000000000001 111.476 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 175.55 177.8 0.18 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.831 -0.622 . . . . 5.1600000000000001 110.359 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.9 -15.93 4.0 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.553 -0.294 . . . . 5.21 111.621 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.87 -49.39 59.25 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.575 0.226 . . . . 3.8300000000000001 110.76 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.69 -46.45 90.31 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.561 -0.533 . . . . 5.25 109.561 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.75 178.9 0.12 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.697 -0.683 . . . . 5.9299999999999997 111.881 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.686 ' HE2' ' HB3' ' A' ' 100' ' ' GLU . 0.9 OUTLIER -165.0 105.33 0.79 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.75 -0.659 . . . . 1.8799999999999999 110.535 -179.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -47.18 -32.39 4.36 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.512 -0.313 . . . . 3.5899999999999999 111.057 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLN . . . . . 0.427 ' HB2' ' HG2' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -66.82 -70.79 0.23 Allowed 'General case' 0 C--N 1.334 -0.074 0 CA-C-N 116.142 -0.481 . . . . 3.2599999999999998 111.305 179.488 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.624 ' CD1' ' HA3' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -52.86 -31.24 38.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.974 -0.557 . . . . 1.96 112.272 -179.199 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASP . . . . . 0.53 ' HA ' HG22 ' A' ' 22' ' ' VAL . 71.0 m-20 -76.24 -55.78 5.25 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.724 0.297 . . . . 2.1499999999999999 111.365 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 95.0 m -63.58 -28.47 69.95 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.393 -0.367 . . . . 1.51 110.909 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' TYR . . . . . 0.63 ' HA ' ' HD3' ' A' ' 131' ' ' LYS . 3.2 m-85 -70.52 -57.24 4.98 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.551 -0.295 . . . . 2.3300000000000001 110.274 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ILE . . . . . 0.735 HG13 ' HB ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -56.1 -30.48 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 112.161 0.43 . . . . 1.23 112.161 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 32.8 t -71.58 -49.61 38.89 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.862 0.319 . . . . 1.55 111.862 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.63 ' HD3' ' HA ' ' A' ' 128' ' ' TYR . 0.0 OUTLIER -82.98 -28.53 29.66 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.306 0.484 . . . . 4.2999999999999998 112.306 -179.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' TYR . . . . . 0.484 ' HB2' ' O ' ' A' ' 128' ' ' TYR . 5.5 m-85 -65.09 -12.49 51.32 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.161 0.43 . . . . 2.29 112.161 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLN . . . . . 0.61 ' HA ' ' CG2' ' A' ' 3' ' ' ILE . 2.0 mt-30 -39.01 -36.39 0.28 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.006 0.373 . . . . 2.71 112.006 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.698 ' CB ' ' HD2' ' A' ' 135' ' ' PRO . 0.3 OUTLIER -62.22 -173.51 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 116.527 -0.306 . . . . 2.8199999999999998 110.969 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . 0.698 ' HD2' ' CB ' ' A' ' 134' ' ' ASP . 19.6 Cg_endo -55.72 -46.87 28.57 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.776 2.317 . . . . 5.3499999999999996 115.369 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.3 m -150.1 -33.58 0.18 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 115.062 1.505 . . . . 5.5300000000000002 115.062 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLN . . . . . 0.457 ' OE1' ' HB2' ' A' ' 134' ' ' ASP . 1.1 mp0 64.72 36.11 8.4 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.894 -0.78 . . . . 6.1600000000000001 108.894 -176.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -76.04 55.79 0.95 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.217 -0.901 . . . . 3.8199999999999998 111.567 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.6 t70 60.98 60.94 1.72 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.176 -0.466 . . . . 5.3899999999999997 110.948 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.405 -0.807 . . . . 6.3899999999999997 111.182 -179.936 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HA ' ' HB2' ' A' ' 84' ' ' GLN . 19.8 mtp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.61 0.226 . . . . 4.3 111.61 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -156.55 155.47 31.97 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.82 0.343 . . . . 2.87 111.418 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 1.037 HG22 ' HA ' ' A' ' 133' ' ' GLN . 17.2 tt -66.93 133.86 30.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.079 -0.51 . . . . 0.71 109.934 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -106.45 -26.08 11.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.288 0.847 . . . . 2.42 113.288 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.622 ' CD2' ' HB3' ' A' ' 40' ' ' MET . 21.4 t80 -152.6 147.86 26.66 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 113.101 0.778 . . . . 1.15 113.101 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.882 HG13 HD11 ' A' ' 3' ' ' ILE . 0.8 OUTLIER -142.14 162.25 19.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.66 -1.155 . . . . 0.41 108.692 177.643 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.63 ' HA2' ' CD1' ' A' ' 125' ' ' LEU . . . 164.56 -164.05 36.59 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 119.617 -1.278 . . . . 0.32 113.364 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.81 ' HB ' ' HB3' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -151.04 143.02 16.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.847 -0.676 . . . . 0.51 109.55 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.667 ' CE1' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -157.01 124.91 5.48 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.793 0.33 . . . . 1.29 111.554 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.641 ' HB2' ' HB ' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -77.38 134.28 38.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 3.0 110.017 178.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.1 100.16 0.57 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.832 0.349 . . . . 1.05 110.903 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.1 -114.13 0.85 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 121.035 -0.602 . . . . 1.83 112.478 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -110.37 -95.26 2.32 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.081 -0.58 . . . . 1.32 112.379 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -67.37 -33.81 75.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.631 0.253 . . . . 3.33 111.092 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.94 -175.74 4.01 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 2.59 110.203 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.521 ' CB ' ' HB3' ' A' ' 48' ' ' ALA . . . -97.08 129.68 44.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.73 0.3 . . . . 0.86 111.489 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.5 102.42 0.42 Allowed 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.006 -0.543 . . . . 1.71 109.839 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -49.77 104.16 0.06 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.999 -0.546 . . . . 3.25 112.354 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.81 ' HB3' ' HB ' ' A' ' 8' ' ' VAL . 2.1 tp -78.19 -51.85 9.57 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.783 -0.644 . . . . 1.6 110.03 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.651 ' OG ' HG23 ' A' ' 8' ' ' VAL . 13.4 p -156.19 147.69 22.68 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.797 -0.638 . . . . 1.34 109.742 178.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -134.12 113.17 11.78 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.421 0.897 . . . . 2.5 113.421 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.632 ' CG1' HG21 ' A' ' 129' ' ' ILE . 12.0 p -120.82 136.23 58.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.533 -0.758 . . . . 0.6 109.352 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HG3' ' CD2' ' A' ' 5' ' ' TYR . 0.9 OUTLIER -125.66 158.4 34.84 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 113.124 0.787 . . . . 2.13 113.124 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.506 ' HB2' HD11 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -126.94 106.57 9.39 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.475 -1.239 . . . . 1.6 107.96 176.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.794 HD13 ' HB2' ' A' ' 33' ' ' ARG . 4.2 mt -114.02 74.1 0.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.276 0.56 . . . . 1.66 110.931 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.2 m -90.71 -51.53 5.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.428 -0.805 . . . . 1.92 111.752 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -82.48 -19.1 39.49 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.462 0.542 . . . . 2.47 112.462 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.566 ' CD2' ' HA ' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -87.73 127.34 35.31 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.624 0.249 . . . . 1.51 110.798 -179.548 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.71 -175.37 4.5 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.357 -0.449 . . . . 1.65 113.494 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 33' ' ' ARG . 53.8 p90 -58.91 -36.62 75.01 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 111.65 0.241 . . . . 3.62 111.65 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -90.6 -36.86 14.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.607 -0.27 . . . . 3.45 110.99 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.772 ' O ' HG23 ' A' ' 36' ' ' VAL . 11.5 tt0 -67.0 -46.04 75.75 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 116.309 -0.405 . . . . 2.69 111.027 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.794 ' HB2' HD13 ' A' ' 25' ' ' LEU . 9.4 ptm180 -49.31 -35.58 18.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 3.21 111.675 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.4 t -64.94 -52.59 55.53 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.781 0.324 . . . . 1.06 110.529 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.8 m -62.72 -45.34 93.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.047 -0.524 . . . . 1.52 110.95 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.772 HG23 ' O ' ' A' ' 32' ' ' GLU . 2.7 t -65.96 -37.26 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 116.573 -0.285 . . . . 0.71 110.822 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.22 -45.72 92.39 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.863 -0.895 . . . . 0.58 110.863 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -60.6 -39.96 90.05 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 108.953 -0.758 . . . . 2.36 108.953 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.443 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 0.3 OUTLIER -58.72 -45.71 88.96 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 115.609 -0.723 . . . . 1.82 110.234 178.358 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.622 ' HB3' ' CD2' ' A' ' 5' ' ' TYR . 24.6 mtt -60.21 -59.52 5.28 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.603 -0.726 . . . . 1.51 112.286 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.31 -56.0 26.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.584 -0.28 . . . . 0.63 111.73 -179.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.515 ' HA ' ' HG2' ' A' ' 45' ' ' GLU . 14.3 t80 -50.92 -37.85 46.56 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.92 0.39 . . . . 1.53 110.957 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.801 ' O ' HG22 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -74.75 -37.57 62.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 1.6 110.289 178.808 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 1.019 ' HB2' HD11 ' A' ' 80' ' ' ILE . . . -69.21 -35.69 76.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.18 -0.464 . . . . 0.35 111.312 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 42' ' ' PHE . 9.5 pt-20 -73.29 -34.02 65.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.122 -0.695 . . . . 1.28 109.122 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.457 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 1.2 m -65.19 -49.38 70.0 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.62 109.901 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.921 ' HB ' HG21 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -55.29 -55.65 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 O-C-N 123.029 0.206 . . . . 0.6 110.845 179.577 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.587 ' CB ' ' HB2' ' A' ' 9' ' ' PHE . . . -55.78 -29.96 60.52 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.355 -0.609 . . . . 0.65 109.355 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.443 ' N ' ' HB2' ' A' ' 16' ' ' ALA . 7.5 t -72.27 -45.97 57.87 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.045 -0.525 . . . . 1.06 109.889 177.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.634 ' CG ' ' HA ' ' A' ' 47' ' ' VAL . 2.1 ptp180 -74.46 -17.91 60.71 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 116.666 -0.243 . . . . 1.94 111.019 178.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.89 ' OG1' HG11 ' A' ' 68' ' ' VAL . 51.7 m -88.71 106.61 18.46 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.372 -0.973 . . . . 0.84 108.372 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.87 36.91 2.31 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 114.869 0.707 . . . . 1.06 114.869 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.683 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . . . 63.46 140.54 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 117.389 0.594 . . . . 1.06 112.41 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.39 4.62 80.28 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.986 -0.626 . . . . 1.03 112.334 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.54 165.26 25.61 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.915 0.388 . . . . 2.66 111.355 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -114.09 151.4 32.61 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.954 -0.566 . . . . 3.15 110.772 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.575 ' O ' ' HB ' ' A' ' 68' ' ' VAL . 8.8 mm-40 -137.89 124.81 21.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 1.9 112.112 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -117.8 102.01 8.77 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 107.714 -1.217 . . . . 1.49 107.714 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.754 ' CD1' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -86.05 108.56 17.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.724 -0.671 . . . . 0.78 111.787 -177.818 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.2 108.27 16.99 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.521 -0.763 . . . . 2.63 110.371 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -108.95 163.63 13.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.865 -0.607 . . . . 2.07 110.638 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -78.28 54.68 3.97 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 120.952 -0.642 . . . . 1.94 112.092 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -179.73 -42.59 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.723 0.409 . . . . 3.51 110.532 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -158.23 178.53 10.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.199 0.524 . . . . 2.52 111.705 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.56 HG21 ' CE1' ' A' ' 67' ' ' HIS . 3.2 mt -108.3 160.88 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.44 -0.8 . . . . 0.9 110.548 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.721 ' HA3' HG13 ' A' ' 59' ' ' ILE . . . -132.2 78.23 0.37 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.754 -0.736 . . . . 0.56 111.961 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.732 ' CE1' HG22 ' A' ' 87' ' ' VAL . 73.4 m-70 -61.44 149.96 36.97 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.911 0.386 . . . . 0.8 111.242 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 1.054 HG22 HG22 ' A' ' 78' ' ' VAL . 2.1 t -145.08 141.1 22.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.184 -0.462 . . . . 0.55 111.022 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.765 ' OH ' HG12 ' A' ' 87' ' ' VAL . 83.8 m-85 -141.02 111.38 6.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.816 -0.629 . . . . 1.89 109.777 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.683 ' HB1' ' HA ' ' A' ' 53' ' ' ALA . . . -98.28 155.11 17.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.039 -0.528 . . . . 0.71 112.266 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 176.68 5.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.542 -0.754 . . . . 4.07 110.747 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 t -98.57 36.35 1.65 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.416 -0.356 . . . . 2.06 111.327 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -122.58 -40.53 2.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.44 -0.346 . . . . 4.62 111.57 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 142.42 -22.23 2.39 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 121.263 -0.494 . . . . 1.04 112.593 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.641 ' HB ' ' HB2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -108.13 118.77 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 109.469 -0.567 . . . . 0.96 109.469 179.462 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' CYS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 26.5 p -108.79 165.9 11.21 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.129 -0.487 . . . . 1.28 112.193 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.66 ' HA2' ' HA ' ' A' ' 8' ' ' VAL . . . -118.03 149.93 18.34 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 115.747 -0.66 . . . . 0.43 111.487 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 1.054 HG22 HG22 ' A' ' 68' ' ' VAL . 2.6 t -118.23 144.84 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 120.11 -0.636 . . . . 0.46 112.619 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.908 HD12 HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -134.25 99.29 4.35 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.233 -0.894 . . . . 1.66 110.767 -179.648 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.019 HD11 ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -99.83 117.77 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.886 0.374 . . . . 0.85 111.943 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.819 HG21 ' CD1' ' A' ' 85' ' ' TYR . 4.3 t -140.51 167.72 21.49 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.22 -0.445 . . . . 0.75 111.546 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.82 160.49 20.19 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.35 -0.386 . . . . 1.67 111.057 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -21.3 61.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.194 -0.457 . . . . 3.4 111.195 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 7.1 mm-40 -86.49 26.53 1.07 Allowed 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.016 0.436 . . . . 2.9 111.294 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TYR . . . . . 0.819 ' CD1' HG21 ' A' ' 81' ' ' THR . 0.5 OUTLIER -135.6 91.16 18.59 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 106.683 -1.599 . . . . 1.54 106.683 178.769 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -47.53 161.29 0.3 Allowed 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 123.307 2.671 . . . . 1.18 114.048 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.765 HG12 ' OH ' ' A' ' 69' ' ' TYR . 1.7 t -75.36 -26.41 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 1.5 111.625 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.504 ' HB2' ' HD3' ' A' ' 89' ' ' PRO . 2.2 mmm-85 -55.77 -56.07 33.97 Favored Pre-proline 0 N--CA 1.466 0.364 0 N-CA-C 111.518 0.192 . . . . 2.83 111.518 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 88' ' ' ARG . 39.7 Cg_endo -65.52 -29.86 52.61 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.752 1.635 . . . . 0.95 111.039 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -68.51 -29.99 68.71 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.904 -1.147 . . . . 0.67 107.904 176.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.511 ' O ' ' HB2' ' A' ' 95' ' ' ASN . 1.0 OUTLIER -67.45 -47.05 71.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.152 -1.055 . . . . 1.73 108.152 177.005 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.3 m -61.32 -43.35 99.02 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 115.751 -0.659 . . . . 0.86 110.504 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.885 ' HB3' HD11 ' A' ' 79' ' ' LEU . 3.3 tt -65.17 -51.77 59.05 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.987 -0.551 . . . . 1.33 110.732 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.908 HD23 HD12 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -68.8 -9.1 49.13 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.389 -0.369 . . . . 2.52 110.252 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.511 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 5.8 t-20 -76.93 -52.67 9.0 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 109.417 -0.586 . . . . 1.67 109.417 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 100' ' ' GLU . 1.3 mptp? -67.29 -37.71 83.84 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.542 -0.754 . . . . 2.55 110.948 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.719 ' CG2' ' HA ' ' A' ' 94' ' ' LEU . 6.4 tt -62.76 -53.78 42.45 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 N-CA-C 112.15 0.426 . . . . 0.99 112.15 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.606 ' N ' HG23 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.908 -0.317 . . . . 1.49 110.492 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.52 -30.62 70.33 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.532 -0.544 . . . . 1.66 109.532 178.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.736 ' HB3' ' HE3' ' A' ' 122' ' ' MET . 10.3 tp10 -69.49 -37.57 77.29 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.186 -0.915 . . . . 1.82 109.829 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' TYR . . . . . 0.554 ' CZ ' HD21 ' A' ' 19' ' ' LEU . 26.8 t80 -65.4 -34.55 78.56 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.719 -0.475 . . . . 1.37 109.719 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -72.49 -26.52 61.82 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.695 -0.229 . . . . 1.55 111.268 179.133 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -80.97 -51.19 15.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.554 0.575 . . . . 1.21 112.554 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -44.93 -25.46 0.31 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.083 0.468 . . . . 1.19 110.59 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.574 ' HB2' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -168.45 131.36 1.26 Allowed Pre-proline 0 N--CA 1.45 -0.437 0 CA-C-N 115.339 -0.846 . . . . 1.08 109.425 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -33.0 149.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 124.069 3.179 . . . . 1.26 114.5 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.757 ' HA ' ' CZ2' ' A' ' 110' ' ' TRP . 0.5 OUTLIER -47.14 -49.96 21.27 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.297 -0.865 . . . . 3.37 112.423 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -75.24 -26.53 58.93 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.27 0.47 . . . . 2.93 112.27 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.574 ' HG2' ' HB2' ' A' ' 105' ' ' HIS . 0.6 OUTLIER -45.67 -43.11 12.32 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.698 0.285 . . . . 1.83 111.176 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' TRP . . . . . 0.977 ' HB2' HG22 ' A' ' 113' ' ' VAL . 0.5 OUTLIER -95.67 -51.28 4.58 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.243 -0.435 . . . . 1.02 110.246 179.097 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 112' ' ' ASP . . . 37.24 55.52 1.33 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.669 -0.696 . . . . 1.47 111.753 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.617 ' HB2' ' O ' ' A' ' 111' ' ' ALA . 2.0 m-20 100.86 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.801 1.24 . . . . 2.25 110.685 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.977 HG22 ' HB2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER 59.45 104.85 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.244 -0.434 . . . . 1.97 111.741 178.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 32.6 p -81.58 10.12 6.48 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.895 -0.593 . . . . 1.98 110.126 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -161.94 96.96 1.03 Allowed 'General case' 0 C--N 1.347 0.494 0 N-CA-C 112.119 0.415 . . . . 2.13 112.119 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.535 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -145.9 172.91 12.66 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.31 -0.404 . . . . 2.14 111.476 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . 0.42 ' H ' HG22 ' A' ' 116' ' ' THR . 0.7 OUTLIER 175.55 177.8 0.18 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.831 -0.622 . . . . 4.52 110.359 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.9 -15.93 4.0 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.553 -0.294 . . . . 5.21 111.621 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.87 -49.39 59.25 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.575 0.226 . . . . 3.44 110.76 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.69 -46.45 90.31 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.561 -0.533 . . . . 4.87 109.561 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.75 178.9 0.12 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.697 -0.683 . . . . 5.6 111.881 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.736 ' HE3' ' HB3' ' A' ' 100' ' ' GLU . 0.9 OUTLIER -165.0 105.33 0.79 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.75 -0.659 . . . . 1.31 110.535 -179.879 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -47.18 -32.39 4.36 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.512 -0.313 . . . . 3.22 111.057 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -66.82 -70.79 0.23 Allowed 'General case' 0 C--N 1.334 -0.074 0 CA-C-N 116.142 -0.481 . . . . 2.59 111.305 179.488 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.649 HD22 ' HB2' ' A' ' 122' ' ' MET . 0.0 OUTLIER -52.86 -31.24 38.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.974 -0.557 . . . . 1.37 112.272 -179.199 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASP . . . . . 0.506 ' HA ' HG21 ' A' ' 22' ' ' VAL . 71.0 m-20 -76.24 -55.78 5.25 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.724 0.297 . . . . 2.15 111.365 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 95.0 m -63.58 -28.47 69.95 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.393 -0.367 . . . . 1.05 110.909 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' TYR . . . . . 0.661 ' HA ' ' HD3' ' A' ' 131' ' ' LYS . 3.2 m-85 -70.52 -57.24 4.98 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.551 -0.295 . . . . 1.48 110.274 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ILE . . . . . 0.835 ' HB ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -56.1 -30.48 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 112.161 0.43 . . . . 0.63 112.161 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 32.8 t -71.58 -49.61 38.89 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.862 0.319 . . . . 1.07 111.862 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.661 ' HD3' ' HA ' ' A' ' 128' ' ' TYR . 0.0 OUTLIER -82.98 -28.53 29.66 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.306 0.484 . . . . 3.87 112.306 -179.305 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' TYR . . . . . 0.528 ' HD2' ' HH ' ' A' ' 85' ' ' TYR . 5.5 m-85 -65.09 -12.49 51.32 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.161 0.43 . . . . 1.43 112.161 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLN . . . . . 1.037 ' HA ' HG22 ' A' ' 3' ' ' ILE . 2.0 mt-30 -39.01 -36.39 0.28 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.006 0.373 . . . . 2.26 112.006 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.716 ' CB ' ' HD2' ' A' ' 135' ' ' PRO . 0.3 OUTLIER -62.22 -173.51 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 116.527 -0.306 . . . . 2.82 110.969 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.716 ' HD2' ' CB ' ' A' ' 134' ' ' ASP . 19.6 Cg_endo -55.72 -46.87 28.57 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.776 2.317 . . . . 4.77 115.369 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.3 m -150.1 -33.58 0.18 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 115.062 1.505 . . . . 5.14 115.062 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLN . . . . . 0.488 ' OE1' ' HB2' ' A' ' 134' ' ' ASP . 1.1 mp0 64.72 36.11 8.4 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.894 -0.78 . . . . 5.37 108.894 -176.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -76.04 55.79 0.95 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.217 -0.901 . . . . 3.39 111.567 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.6 t70 60.98 60.94 1.72 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.176 -0.466 . . . . 5.39 110.948 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.405 -0.807 . . . . 6.39 111.182 -179.936 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HA ' ' HB2' ' A' ' 84' ' ' GLN . 19.8 mtp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.61 0.226 . . . . 4.3 111.61 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -156.55 155.47 31.97 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.82 0.343 . . . . 2.87 111.418 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.037 HG22 ' HA ' ' A' ' 133' ' ' GLN . 17.2 tt -66.93 133.86 30.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-N 116.079 -0.51 . . . . 0.71 109.934 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -106.45 -26.08 11.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.288 0.847 . . . . 2.42 113.288 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.622 ' CD2' ' HB3' ' A' ' 40' ' ' MET . 21.4 t80 -152.6 147.86 26.66 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 113.101 0.778 . . . . 1.15 113.101 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.882 HG13 HD11 ' A' ' 3' ' ' ILE . 0.8 OUTLIER -142.14 162.25 19.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 114.66 -1.155 . . . . 0.41 108.692 177.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.63 ' HA2' ' CD1' ' A' ' 125' ' ' LEU . . . 164.56 -164.05 36.59 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 119.617 -1.278 . . . . 0.32 113.364 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.81 ' HB ' ' HB3' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -151.04 143.02 16.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 114.847 -0.676 . . . . 0.51 109.55 -179.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.667 ' CE1' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -157.01 124.91 5.48 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.793 0.33 . . . . 1.29 111.554 -179.131 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.641 ' HB2' ' HB ' ' A' ' 75' ' ' ILE . 0.2 OUTLIER -77.38 134.28 38.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 3.0 110.017 178.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.1 100.16 0.57 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.832 0.349 . . . . 1.05 110.903 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.1 -114.13 0.85 Allowed Glycine 0 C--N 1.332 0.335 0 C-N-CA 121.035 -0.602 . . . . 1.83 112.478 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -110.37 -95.26 2.32 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 121.081 -0.58 . . . . 1.32 112.379 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -67.37 -33.81 75.98 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.631 0.253 . . . . 3.33 111.092 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.94 -175.74 4.01 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.206 -0.452 . . . . 2.59 110.203 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.521 ' CB ' ' HB3' ' A' ' 48' ' ' ALA . . . -97.08 129.68 44.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.73 0.3 . . . . 0.86 111.489 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.5 tt -63.5 102.42 0.42 Allowed 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.006 -0.543 . . . . 1.71 109.839 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -49.77 104.16 0.06 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.999 -0.546 . . . . 3.25 112.354 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.81 ' HB3' ' HB ' ' A' ' 8' ' ' VAL . 2.1 tp -78.19 -51.85 9.57 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 115.783 -0.644 . . . . 1.6 110.03 178.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.651 ' OG ' HG23 ' A' ' 8' ' ' VAL . 13.4 p -156.19 147.69 22.68 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.797 -0.638 . . . . 1.34 109.742 178.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -134.12 113.17 11.78 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.421 0.897 . . . . 2.5 113.421 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.632 ' CG1' HG21 ' A' ' 129' ' ' ILE . 12.0 p -120.82 136.23 58.48 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.533 -0.758 . . . . 0.6 109.352 177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.498 ' HG3' ' CD2' ' A' ' 5' ' ' TYR . 0.9 OUTLIER -125.66 158.4 34.84 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 113.124 0.787 . . . . 2.13 113.124 -178.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.506 ' HB2' HD11 ' A' ' 129' ' ' ILE . 0.7 OUTLIER -126.94 106.57 9.39 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 114.475 -1.239 . . . . 1.6 107.96 176.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.794 HD13 ' HB2' ' A' ' 33' ' ' ARG . 4.2 mt -114.02 74.1 0.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.276 0.56 . . . . 1.66 110.931 -178.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.2 m -90.71 -51.53 5.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.428 -0.805 . . . . 1.92 111.752 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -82.48 -19.1 39.49 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.462 0.542 . . . . 2.47 112.462 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.566 ' CD2' ' HA ' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -87.73 127.34 35.31 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.624 0.249 . . . . 1.51 110.798 -179.548 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.71 -175.37 4.5 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.357 -0.449 . . . . 1.65 113.494 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.438 ' HA ' ' HD3' ' A' ' 33' ' ' ARG . 53.8 p90 -58.91 -36.62 75.01 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 111.65 0.241 . . . . 3.62 111.65 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -90.6 -36.86 14.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.607 -0.27 . . . . 3.45 110.99 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.772 ' O ' HG23 ' A' ' 36' ' ' VAL . 11.5 tt0 -67.0 -46.04 75.75 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 116.309 -0.405 . . . . 2.69 111.027 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.794 ' HB2' HD13 ' A' ' 25' ' ' LEU . 9.4 ptm180 -49.31 -35.58 18.61 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.333 -0.394 . . . . 3.21 111.675 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.4 t -64.94 -52.59 55.53 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.781 0.324 . . . . 1.06 110.529 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.8 m -62.72 -45.34 93.2 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.047 -0.524 . . . . 1.52 110.95 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.772 HG23 ' O ' ' A' ' 32' ' ' GLU . 2.7 t -65.96 -37.26 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.132 0 CA-C-N 116.573 -0.285 . . . . 0.71 110.822 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.22 -45.72 92.39 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.863 -0.895 . . . . 0.58 110.863 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -60.6 -39.96 90.05 Favored 'General case' 0 CA--C 1.529 0.171 0 N-CA-C 108.953 -0.758 . . . . 2.36 108.953 177.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.443 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 0.3 OUTLIER -58.72 -45.71 88.96 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 115.609 -0.723 . . . . 1.82 110.234 178.358 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.622 ' HB3' ' CD2' ' A' ' 5' ' ' TYR . 24.6 mtt -60.21 -59.52 5.28 Favored 'General case' 0 CA--C 1.528 0.113 0 CA-C-N 115.603 -0.726 . . . . 1.51 112.286 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -56.31 -56.0 26.44 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.584 -0.28 . . . . 0.63 111.73 -179.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.515 ' HA ' ' HG2' ' A' ' 45' ' ' GLU . 14.3 t80 -50.92 -37.85 46.56 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.92 0.39 . . . . 1.53 110.957 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.801 ' O ' HG22 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -74.75 -37.57 62.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.029 -0.532 . . . . 1.6 110.289 178.808 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 1.019 ' HB2' HD11 ' A' ' 80' ' ' ILE . . . -69.21 -35.69 76.47 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.18 -0.464 . . . . 0.35 111.312 179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 42' ' ' PHE . 9.5 pt-20 -73.29 -34.02 65.52 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.122 -0.695 . . . . 1.28 109.122 178.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.457 ' O ' ' HG2' ' A' ' 50' ' ' ARG . 1.2 m -65.19 -49.38 70.0 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.101 -0.5 . . . . 0.62 109.901 178.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.921 ' HB ' HG21 ' A' ' 68' ' ' VAL . 0.1 OUTLIER -55.29 -55.65 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.465 0 O-C-N 123.029 0.206 . . . . 0.6 110.845 179.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.587 ' CB ' ' HB2' ' A' ' 9' ' ' PHE . . . -55.78 -29.96 60.52 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.355 -0.609 . . . . 0.65 109.355 178.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.443 ' N ' ' HB2' ' A' ' 16' ' ' ALA . 7.5 t -72.27 -45.97 57.87 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.045 -0.525 . . . . 1.06 109.889 177.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.634 ' CG ' ' HA ' ' A' ' 47' ' ' VAL . 2.1 ptp180 -74.46 -17.91 60.71 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 116.666 -0.243 . . . . 1.94 111.019 178.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.89 ' OG1' HG11 ' A' ' 68' ' ' VAL . 51.7 m -88.71 106.61 18.46 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.372 -0.973 . . . . 0.84 108.372 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -80.87 36.91 2.31 Favored Glycine 0 CA--C 1.523 0.544 0 N-CA-C 114.869 0.707 . . . . 1.06 114.869 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.683 ' HA ' ' HB1' ' A' ' 70' ' ' ALA . . . 63.46 140.54 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 117.389 0.594 . . . . 1.06 112.41 179.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 76.39 4.62 80.28 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.986 -0.626 . . . . 1.03 112.334 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -134.54 165.26 25.61 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.915 0.388 . . . . 2.66 111.355 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -114.09 151.4 32.61 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.954 -0.566 . . . . 3.15 110.772 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.575 ' O ' ' HB ' ' A' ' 68' ' ' VAL . 8.8 mm-40 -137.89 124.81 21.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.18 0.514 . . . . 1.9 112.112 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 58.4 m -117.8 102.01 8.77 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 107.714 -1.217 . . . . 1.49 107.714 177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.754 ' CD1' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -86.05 108.56 17.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.724 -0.671 . . . . 0.78 111.787 -177.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -84.2 108.27 16.99 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.521 -0.763 . . . . 2.63 110.371 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -108.95 163.63 13.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.865 -0.607 . . . . 2.07 110.638 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -78.28 54.68 3.97 Favored Glycine 0 C--N 1.336 0.567 0 C-N-CA 120.952 -0.642 . . . . 1.94 112.092 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -179.73 -42.59 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 122.723 0.409 . . . . 3.51 110.532 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -158.23 178.53 10.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.199 0.524 . . . . 2.52 111.705 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.56 HG21 ' CE1' ' A' ' 67' ' ' HIS . 3.2 mt -108.3 160.88 7.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 CA-C-N 115.44 -0.8 . . . . 0.9 110.548 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.721 ' HA3' HG13 ' A' ' 59' ' ' ILE . . . -132.2 78.23 0.37 Allowed Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.754 -0.736 . . . . 0.56 111.961 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.732 ' CE1' HG22 ' A' ' 87' ' ' VAL . 73.4 m-70 -61.44 149.96 36.97 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 120.911 0.386 . . . . 0.8 111.242 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 1.054 HG22 HG22 ' A' ' 78' ' ' VAL . 2.1 t -145.08 141.1 22.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.184 -0.462 . . . . 0.55 111.022 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.765 ' OH ' HG12 ' A' ' 87' ' ' VAL . 83.8 m-85 -141.02 111.38 6.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 115.816 -0.629 . . . . 1.89 109.777 178.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.683 ' HB1' ' HA ' ' A' ' 53' ' ' ALA . . . -98.28 155.11 17.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.039 -0.528 . . . . 0.71 112.266 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.71 176.68 5.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.542 -0.754 . . . . 4.07 110.747 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 1.2 t -98.57 36.35 1.65 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.416 -0.356 . . . . 2.06 111.327 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -122.58 -40.53 2.45 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.44 -0.346 . . . . 4.62 111.57 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 142.42 -22.23 2.39 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 121.263 -0.494 . . . . 1.04 112.593 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.641 ' HB ' ' HB2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -108.13 118.77 56.47 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 N-CA-C 109.469 -0.567 . . . . 0.96 109.469 179.462 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 70' ' ' ALA . 26.5 p -108.79 165.9 11.21 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.129 -0.487 . . . . 1.28 112.193 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.66 ' HA2' ' HA ' ' A' ' 8' ' ' VAL . . . -118.03 149.93 18.34 Favored Glycine 0 C--N 1.334 0.466 0 CA-C-N 115.747 -0.66 . . . . 0.43 111.487 179.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 1.054 HG22 HG22 ' A' ' 68' ' ' VAL . 2.6 t -118.23 144.84 25.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 120.11 -0.636 . . . . 0.46 112.619 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.908 HD12 HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -134.25 99.29 4.35 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.233 -0.894 . . . . 1.66 110.767 -179.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.019 HD11 ' HB2' ' A' ' 44' ' ' ALA . 0.0 OUTLIER -99.83 117.77 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.886 0.374 . . . . 0.85 111.943 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.819 HG21 ' CD1' ' A' ' 85' ' ' TYR . 4.3 t -140.51 167.72 21.49 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.22 -0.445 . . . . 0.75 111.546 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -64.82 160.49 20.19 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.35 -0.386 . . . . 1.67 111.057 179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -21.3 61.19 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.194 -0.457 . . . . 3.4 111.195 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 7.1 mm-40 -86.49 26.53 1.07 Allowed 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.016 0.436 . . . . 2.9 111.294 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TYR . . . . . 0.819 ' CD1' HG21 ' A' ' 81' ' ' THR . 0.5 OUTLIER -135.6 91.16 18.59 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 106.683 -1.599 . . . . 1.54 106.683 178.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_exo -47.53 161.29 0.3 Allowed 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 123.307 2.671 . . . . 1.18 114.048 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.765 HG12 ' OH ' ' A' ' 69' ' ' TYR . 1.7 t -75.36 -26.41 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 115.268 -0.878 . . . . 1.5 111.625 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.504 ' HB2' ' HD3' ' A' ' 89' ' ' PRO . 2.2 mmm-85 -55.77 -56.07 33.97 Favored Pre-proline 0 N--CA 1.466 0.364 0 N-CA-C 111.518 0.192 . . . . 2.83 111.518 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 88' ' ' ARG . 39.7 Cg_endo -65.52 -29.86 52.61 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.752 1.635 . . . . 0.95 111.039 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -68.51 -29.99 68.71 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.904 -1.147 . . . . 0.67 107.904 176.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.511 ' O ' ' HB2' ' A' ' 95' ' ' ASN . 1.0 OUTLIER -67.45 -47.05 71.28 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.152 -1.055 . . . . 1.73 108.152 177.005 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 11.3 m -61.32 -43.35 99.02 Favored 'General case' 0 C--N 1.342 0.268 0 CA-C-N 115.751 -0.659 . . . . 0.86 110.504 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.885 ' HB3' HD11 ' A' ' 79' ' ' LEU . 3.3 tt -65.17 -51.77 59.05 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 115.987 -0.551 . . . . 1.33 110.732 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.908 HD23 HD12 ' A' ' 79' ' ' LEU . 0.2 OUTLIER -68.8 -9.1 49.13 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.389 -0.369 . . . . 2.52 110.252 178.327 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.511 ' HB2' ' O ' ' A' ' 91' ' ' TYR . 5.8 t-20 -76.93 -52.67 9.0 Favored 'General case' 0 C--N 1.344 0.358 0 N-CA-C 109.417 -0.586 . . . . 1.67 109.417 178.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 100' ' ' GLU . 1.3 mptp? -67.29 -37.71 83.84 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 115.542 -0.754 . . . . 2.55 110.948 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.719 ' CG2' ' HA ' ' A' ' 94' ' ' LEU . 6.4 tt -62.76 -53.78 42.45 Favored 'Isoleucine or valine' 0 C--N 1.338 0.104 0 N-CA-C 112.15 0.426 . . . . 0.99 112.15 -179.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.606 ' N ' HG23 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -60.3 -44.85 95.04 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.908 -0.317 . . . . 1.49 110.492 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -67.52 -30.62 70.33 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.532 -0.544 . . . . 1.66 109.532 178.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.736 ' HB3' ' HE3' ' A' ' 122' ' ' MET . 10.3 tp10 -69.49 -37.57 77.29 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.186 -0.915 . . . . 1.82 109.829 178.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' TYR . . . . . 0.554 ' CZ ' HD21 ' A' ' 19' ' ' LEU . 26.8 t80 -65.4 -34.55 78.56 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.719 -0.475 . . . . 1.37 109.719 178.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 98' ' ' LEU . 0.3 OUTLIER -72.49 -26.52 61.82 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.695 -0.229 . . . . 1.55 111.268 179.133 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.9 t -80.97 -51.19 15.91 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 112.554 0.575 . . . . 1.21 112.554 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -44.93 -25.46 0.31 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.083 0.468 . . . . 1.19 110.59 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.592 ' N ' ' CD2' ' A' ' 105' ' ' HIS . 0.0 OUTLIER -168.45 131.36 1.26 Allowed Pre-proline 0 N--CA 1.45 -0.437 0 CA-C-N 115.339 -0.846 . . . . 1.08 109.425 179.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_exo -33.0 149.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 124.069 3.179 . . . . 1.26 114.5 -178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.757 ' HA ' ' CZ2' ' A' ' 110' ' ' TRP . 0.5 OUTLIER -47.14 -49.96 21.27 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.297 -0.865 . . . . 3.37 112.423 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -75.24 -26.53 58.93 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.27 0.47 . . . . 2.93 112.27 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.574 ' HG2' ' HB2' ' A' ' 105' ' ' HIS . 0.6 OUTLIER -45.67 -43.11 12.32 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.698 0.285 . . . . 1.83 111.176 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' TRP . . . . . 0.977 ' HB2' HG22 ' A' ' 113' ' ' VAL . 0.5 OUTLIER -95.67 -51.28 4.58 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.243 -0.435 . . . . 1.02 110.246 179.097 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . 0.617 ' O ' ' HB2' ' A' ' 112' ' ' ASP . . . 37.24 55.52 1.33 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.669 -0.696 . . . . 1.47 111.753 -179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.617 ' HB2' ' O ' ' A' ' 111' ' ' ALA . 2.0 m-20 100.86 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.801 1.24 . . . . 2.25 110.685 -179.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.977 HG22 ' HB2' ' A' ' 110' ' ' TRP . 0.0 OUTLIER 59.45 104.85 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 116.244 -0.434 . . . . 1.97 111.741 178.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' THR . . . . . . . . . . . . . 32.6 p -81.58 10.12 6.48 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.895 -0.593 . . . . 1.98 110.126 177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -161.94 96.96 1.03 Allowed 'General case' 0 C--N 1.347 0.494 0 N-CA-C 112.119 0.415 . . . . 2.13 112.119 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.535 ' HB ' ' HA ' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -145.9 172.91 12.66 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.31 -0.404 . . . . 2.14 111.476 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.42 ' H ' HG22 ' A' ' 116' ' ' THR . 0.7 OUTLIER 175.55 177.8 0.18 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.831 -0.622 . . . . 4.52 110.359 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.9 -15.93 4.0 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.553 -0.294 . . . . 5.21 111.621 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -50.87 -49.39 59.25 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.575 0.226 . . . . 3.44 110.76 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 6.9 mp -60.69 -46.45 90.31 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.561 -0.533 . . . . 4.87 109.561 178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.75 178.9 0.12 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.697 -0.683 . . . . 5.6 111.881 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.736 ' HE3' ' HB3' ' A' ' 100' ' ' GLU . 0.9 OUTLIER -165.0 105.33 0.79 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.75 -0.659 . . . . 1.31 110.535 -179.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -47.18 -32.39 4.36 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.512 -0.313 . . . . 3.22 111.057 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLN . . . . . 0.443 ' HB2' ' HG2' ' A' ' 100' ' ' GLU . 1.0 OUTLIER -66.82 -70.79 0.23 Allowed 'General case' 0 C--N 1.334 -0.074 0 CA-C-N 116.142 -0.481 . . . . 2.59 111.305 179.488 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.649 HD22 ' HB2' ' A' ' 122' ' ' MET . 0.0 OUTLIER -52.86 -31.24 38.38 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.974 -0.557 . . . . 1.37 112.272 -179.199 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASP . . . . . 0.506 ' HA ' HG21 ' A' ' 22' ' ' VAL . 71.0 m-20 -76.24 -55.78 5.25 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.724 0.297 . . . . 2.15 111.365 -179.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 95.0 m -63.58 -28.47 69.95 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.393 -0.367 . . . . 1.05 110.909 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' TYR . . . . . 0.661 ' HA ' ' HD3' ' A' ' 131' ' ' LYS . 3.2 m-85 -70.52 -57.24 4.98 Favored 'General case' 0 C--O 1.224 -0.243 0 CA-C-N 116.551 -0.295 . . . . 1.48 110.274 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ILE . . . . . 0.835 ' HB ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -56.1 -30.48 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 112.161 0.43 . . . . 0.63 112.161 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 32.8 t -71.58 -49.61 38.89 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 111.862 0.319 . . . . 1.07 111.862 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.661 ' HD3' ' HA ' ' A' ' 128' ' ' TYR . 0.0 OUTLIER -82.98 -28.53 29.66 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.306 0.484 . . . . 3.87 112.306 -179.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' TYR . . . . . 0.528 ' HD2' ' HH ' ' A' ' 85' ' ' TYR . 5.5 m-85 -65.09 -12.49 51.32 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.161 0.43 . . . . 1.43 112.161 -179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLN . . . . . 1.037 ' HA ' HG22 ' A' ' 3' ' ' ILE . 2.0 mt-30 -39.01 -36.39 0.28 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.006 0.373 . . . . 2.26 112.006 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.716 ' CB ' ' HD2' ' A' ' 135' ' ' PRO . 0.3 OUTLIER -62.22 -173.51 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.756 0 CA-C-N 116.527 -0.306 . . . . 2.82 110.969 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.716 ' HD2' ' CB ' ' A' ' 134' ' ' ASP . 19.6 Cg_endo -55.72 -46.87 28.57 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.776 2.317 . . . . 4.77 115.369 -177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 35.3 m -150.1 -33.58 0.18 Allowed 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 115.062 1.505 . . . . 5.14 115.062 -177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLN . . . . . 0.488 ' OE1' ' HB2' ' A' ' 134' ' ' ASP . 1.1 mp0 64.72 36.11 8.4 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.894 -0.78 . . . . 5.37 108.894 -176.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -76.04 55.79 0.95 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 115.217 -0.901 . . . . 3.39 111.567 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ASP . . . . . . . . . . . . . 2.6 t70 60.98 60.94 1.72 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.176 -0.466 . . . . 5.39 110.948 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.405 -0.807 . . . . 6.39 111.182 -179.936 . . . . . . . . 0 0 . 1 stop_ save_