data_1g5j_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 1g5j _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 . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.848 0.356 . . . . 5.4500000000000002 111.207 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.7 -47.97 9.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.443 . . . . 4.9100000000000001 110.865 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -30.39 13.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 6.2999999999999998 110.974 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -49.86 -28.33 6.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 2.0600000000000001 111.665 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -30.63 2.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.321 -0.399 . . . . 3.1400000000000001 110.849 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.91 -31.62 18.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.983 -0.553 . . . . 2.71 111.231 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -35.86 14.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.316 . . . . 3.3799999999999999 110.847 -179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.8 m -80.65 -39.7 26.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 1.52 111.038 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.403 ' HB3' ' CD1' ' A' ' 178' ' ' LEU . 1.0 OUTLIER -72.86 -33.04 65.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.405 . . . . 2.7200000000000002 111.837 -179.397 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' O ' ' CG1' ' A' ' 14' ' ' VAL . 9.0 tpt180 -56.65 -55.67 31.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.727 -0.471 . . . . 2.7599999999999998 109.727 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -25.72 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.132 0.492 . . . . 2.6800000000000002 109.928 178.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.83 -53.38 56.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.645 -0.872 . . . . 2.1000000000000001 108.645 178.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.414 HG21 ' N ' ' A' ' 14' ' ' VAL . 25.3 m -68.0 -38.9 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.147 -1.388 . . . . 2.0499999999999998 111.636 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.414 ' N ' HG21 ' A' ' 13' ' ' VAL . 1.8 m -70.32 -36.29 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-O 120.928 0.394 . . . . 1.4199999999999999 110.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -70.18 -55.34 9.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.935 -0.575 . . . . 1.9299999999999999 110.641 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.418 ' CE1' ' HA ' ' A' ' 149' ' ' SER . 2.6 t80 -52.82 -49.06 66.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 2.4100000000000001 110.223 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.4 ' CD1' ' CB ' ' A' ' 171' ' ' ALA . 19.7 mt -50.23 -51.99 39.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.849 -0.614 . . . . 1.8999999999999999 110.375 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.445 ' CB ' ' CD1' ' A' ' 28' ' ' TRP . 1.4 p -59.3 -41.92 90.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 1.6499999999999999 110.728 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -31.92 42.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.984 0.421 . . . . 2.2400000000000002 110.197 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -74.2 -45.99 44.76 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.992 -0.549 . . . . 2.1200000000000001 111.034 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.438 ' HB3' ' HB2' ' A' ' 26' ' ' TYR . 3.8 mm? -56.09 -32.74 64.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.95 0.405 . . . . 1.6200000000000001 110.184 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.73 -47.72 70.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.063 -0.517 . . . . 1.6699999999999999 110.92 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -42.49 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 2.9500000000000002 110.691 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.58 1.5 54.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.085 -0.507 . . . . 3.2200000000000002 111.752 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.9 47.0 90.16 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.405 -0.902 . . . . 1.0900000000000001 112.047 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.438 ' HB2' ' HB3' ' A' ' 21' ' ' LEU . 7.0 m-85 -107.42 131.04 54.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.758 0.313 . . . . 1.3200000000000001 110.391 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.411 ' O ' ' CE2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -72.1 87.68 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.467 -0.333 . . . . 1.8899999999999999 111.294 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.445 ' CD1' ' CB ' ' A' ' 18' ' ' SER . 74.0 t-105 -58.1 -19.97 36.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.373 -0.376 . . . . 0.88 111.509 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.404 ' HA ' ' CG1' ' A' ' 34' ' ' VAL . 0.8 OUTLIER -85.15 10.83 11.14 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.211 0.449 . . . . 2.21 112.211 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -113.44 15.9 18.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.614 0.245 . . . . 3.4500000000000002 110.923 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.411 ' CE2' ' O ' ' A' ' 27' ' ' SER . 12.7 m-85 -126.16 -43.7 1.78 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.817 0.341 . . . . 2.02 110.83 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.47 -87.16 0.58 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.248 -0.433 . . . . 2.04 111.233 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 169.48 42.73 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.164 0.507 . . . . 2.8599999999999999 110.83 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . 0.404 ' CG1' ' HA ' ' A' ' 29' ' ' SER . 2.4 p -61.73 83.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.008 -0.542 . . . . 3.1699999999999999 111.254 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.21 -74.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.137 -0.483 . . . . 4.4900000000000002 110.899 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.87 -178.3 0.54 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 4.9199999999999999 110.844 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -48.36 168.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 5.1900000000000004 110.908 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.87 100.55 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 4.9500000000000002 110.913 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 6.0 m -132.75 85.01 2.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.223 -0.444 . . . . 2.6600000000000001 110.955 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 61.37 155.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.201 -0.454 . . . . 3.6600000000000001 110.88 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . 165.98 107.26 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.041 -0.527 . . . . 2.3399999999999999 109.887 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -101.14 -3.64 0.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.496 2.797 . . . . 3.23 113.669 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -119.85 -62.71 1.46 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.836 0.351 . . . . 2.96 110.848 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.65 -82.33 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.717 . . . . 0.98999999999999999 112.479 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.28 37.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.923 0.392 . . . . 2.0699999999999998 110.673 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -49.53 -66.9 0.32 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.092 -0.504 . . . . 1.28 111.102 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -45.88 -41.47 11.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.213 -0.449 . . . . 1.1499999999999999 111.226 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -54.87 -59.71 4.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.489 -0.323 . . . . 2.4500000000000002 110.603 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.5 -32.43 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 1.2 110.732 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.11 -40.57 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.927 -0.579 . . . . 1.1599999999999999 110.865 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -61.48 -57.08 13.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 1.51 110.628 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -54.42 -43.7 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 2.3700000000000001 110.883 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.419 ' HB1' ' CZ ' ' A' ' 195' ' ' PHE . . . -49.22 -51.65 31.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 1.1399999999999999 110.746 179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.447 ' CD1' ' CZ ' ' A' ' 195' ' ' PHE . 1.3 mp -64.3 -34.03 77.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.078 -0.51 . . . . 1.25 110.859 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -62.25 -48.04 81.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 3.8300000000000001 110.926 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.89 -64.04 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 1.8500000000000001 110.723 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -52.23 -41.74 63.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 1.1200000000000001 110.636 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.415 ' N ' ' CG1' ' A' ' 145' ' ' VAL . . . -58.47 -30.95 65.76 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.712 -0.756 . . . . 0.56000000000000005 111.967 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.35 -35.67 71.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.018 0.437 . . . . 1.77 109.931 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.2 -39.87 91.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.737 -0.665 . . . . 2.02 110.629 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.45 ' CZ ' ' CD1' ' B' ' 312' ' ' LEU . 3.0 t80 -66.85 -56.15 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 2.2599999999999998 110.85 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -54.63 -45.82 73.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 2.1000000000000001 110.734 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.07 -30.59 71.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.125 -0.489 . . . . 2.5 110.853 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 -58.33 6.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 3.6600000000000001 111.063 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -144.87 82.41 1.67 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.351 -0.386 . . . . 4.5199999999999996 111.265 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -18.32 58.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 2.7999999999999998 111.269 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -47.09 -55.4 8.41 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.882 0.372 . . . . 4.2300000000000004 110.446 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -53.77 -29.75 41.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.139 -0.482 . . . . 1.27 110.283 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -90.12 52.34 2.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.902 -0.59 . . . . 1.5800000000000001 110.664 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.1 t -116.61 -158.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 2.2599999999999998 110.506 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -64.13 111.07 2.4 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.755 0.312 . . . . 2.2200000000000002 110.573 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.446 ' CD2' ' CZ ' ' B' ' 308' ' ' TYR . 12.7 mt -97.81 -25.88 14.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 1.96 111.653 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.1 p -70.54 -26.04 63.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.342 -0.39 . . . . 1.2 111.411 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -27.93 61.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.516 -0.311 . . . . 1.9399999999999999 111.048 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -79.95 -53.94 6.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 1.77 111.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -112.15 173.29 6.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.857 0.36 . . . . 2.0 111.162 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -90.11 108.41 19.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 3.4500000000000002 110.982 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 4.4 mm -106.03 101.17 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 1.51 111.017 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.82 151.9 57.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 1.3700000000000001 110.982 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.22 106.12 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 1.29 112.292 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 116.43 -27.61 7.95 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.756 -0.735 . . . . 1.1599999999999999 112.531 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.66 -28.07 13.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.705 0.288 . . . . 1.73 111.08 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -47.42 -30.57 3.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.392 -0.367 . . . . 1.22 111.23 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' TYR . . . . . 0.446 ' CG ' ' N ' ' A' ' 125' ' ' GLN . 0.4 OUTLIER -58.85 -42.32 89.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 1.8999999999999999 110.508 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . 0.446 ' N ' ' CG ' ' A' ' 124' ' ' TYR . 1.0 OUTLIER -54.99 -49.12 72.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 3.1699999999999999 110.494 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.66 -62.93 1.51 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.916 -0.584 . . . . 1.99 110.908 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -43.31 -57.59 2.94 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.023 -0.535 . . . . 2.3599999999999999 111.518 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.16 -41.94 38.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.847 0.356 . . . . 2.5099999999999998 110.56 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -68.54 -68.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 2.1299999999999999 110.615 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.458 HG22 ' CE1' ' A' ' 150' ' ' PHE . 0.2 OUTLIER -43.76 -51.45 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 116.075 -0.511 . . . . 1.6899999999999999 111.061 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.418 HG23 ' CZ ' ' A' ' 177' ' ' TYR . 0.3 OUTLIER -59.26 -33.81 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 1.1899999999999999 111.322 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -62.11 -67.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 2.3900000000000001 111.009 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -64.21 -14.69 57.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 2.52 112.001 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 24.9 tp -80.26 -44.93 18.81 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.729 0.27 . . . . 2.0600000000000001 111.729 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -116.95 23.19 12.08 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.975 0.361 . . . . 2.23 111.975 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.76 -75.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.786 0.326 . . . . 5.2400000000000002 111.11 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -115.62 75.91 0.97 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 3.1400000000000001 111.09 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 138.15 141.23 4.14 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.641 -0.79 . . . . 1.5 112.779 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 88.3 t -130.76 -80.38 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.683 0.278 . . . . 2.1099999999999999 110.556 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 57.6 160.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.188 0.518 . . . . 1.74 111.783 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.473 ' CZ3' ' CH2' ' A' ' 185' ' ' TRP . 10.7 m95 -55.76 -28.88 58.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.952 -0.567 . . . . 0.38 110.338 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -57.52 -59.57 10.59 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.069 -0.586 . . . . 0.33000000000000002 113.02 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -61.3 -31.54 71.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.853 0.326 . . . . 2.4199999999999999 110.801 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . 0.416 HD12 ' CZ3' ' A' ' 185' ' ' TRP . 1.3 mm -59.31 -59.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 1.3799999999999999 111.179 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . 0.415 ' CG1' ' N ' ' A' ' 98' ' ' GLY . 70.6 t -52.43 -48.6 45.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.795 0.331 . . . . 2.0099999999999998 111.106 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.09 75.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 1.1399999999999999 111.131 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' PHE . . . . . 0.401 ' CZ ' ' HA ' ' A' ' 174' ' ' MET . 13.9 t80 -61.6 -43.81 98.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 2.5699999999999998 110.809 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.434 ' CD1' ' CD2' ' A' ' 94' ' ' LEU . 15.7 m-85 -60.67 -52.74 63.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 1.75 110.604 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . 0.418 ' HA ' ' CE1' ' A' ' 16' ' ' PHE . 1.4 t -60.82 -36.12 78.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.139 0.495 . . . . 1.1299999999999999 109.971 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' PHE . . . . . 0.542 ' CE1' ' CE2' ' B' ' 308' ' ' TYR . 4.3 t80 -47.92 -66.89 0.33 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.459 -0.791 . . . . 4.4100000000000001 110.447 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -58.55 -26.65 60.02 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.753 -0.737 . . . . 0.46000000000000002 112.064 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLY . . . . . . . . . . . . . . . -57.26 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.691 -0.766 . . . . 0.40000000000000002 112.271 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -61.04 -34.72 75.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.911 0.386 . . . . 1.22 110.861 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 1.5 tp -65.59 -31.5 72.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 1.8 110.576 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -56.97 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 1.6399999999999999 110.894 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' VAL . . . . . 0.406 ' HA ' ' CG2' ' A' ' 159' ' ' VAL . 21.7 t -53.32 -32.07 19.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.329 -0.396 . . . . 1.7 110.605 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -43.96 84.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 1.8100000000000001 110.702 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -59.77 3.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 1.76 110.691 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' VAL . . . . . 0.406 ' CG2' ' HA ' ' A' ' 156' ' ' VAL . 0.0 OUTLIER -46.93 -35.66 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 1.46 110.998 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -62.69 -28.26 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 1.75 111.348 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 27.32 3.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.345 . . . . 2.6600000000000001 111.356 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 63.24 32.45 14.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.82 0.343 . . . . 2.1800000000000002 110.925 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 3.7 mtm -132.33 87.82 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.3700000000000001 110.731 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -94.62 -20.12 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 2.5 111.612 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 78.4 t -48.94 -29.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.783 0.325 . . . . 1.3400000000000001 111.18 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -79.69 -24.7 41.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.251 -0.431 . . . . 2.0 111.462 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 45.1 t -52.96 -79.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.732 0.301 . . . . 1.1399999999999999 111.43 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.64 -44.72 63.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 1.8 110.984 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.412 ' HB3' ' CZ2' ' A' ' 173' ' ' TRP . 7.5 mtt180 -52.9 -37.97 61.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 2.3900000000000001 110.946 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ILE . . . . . 0.412 ' HA ' ' CE3' ' A' ' 173' ' ' TRP . 42.4 mt -74.89 -42.98 46.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 1.1299999999999999 111.071 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ALA . . . . . 0.4 ' CB ' ' CD1' ' A' ' 17' ' ' LEU . . . -53.18 -47.76 68.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.291 -0.413 . . . . 1.1799999999999999 110.821 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.83 97.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.135 -0.484 . . . . 1.28 110.856 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' TRP . . . . . 0.412 ' CZ2' ' HB3' ' A' ' 169' ' ' ARG . 50.1 m0 -60.36 -42.22 95.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.80000000000000004 111.092 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' MET . . . . . 0.401 ' HA ' ' CZ ' ' A' ' 147' ' ' PHE . 42.8 mtp -63.79 -40.76 97.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 1.52 111.399 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -74.16 -55.65 5.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.245 -0.434 . . . . 1.1799999999999999 111.488 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 1.3 m -54.66 -29.68 53.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.606 -0.27 . . . . 1.23 111.055 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' TYR . . . . . 0.418 ' CZ ' HG23 ' A' ' 131' ' ' VAL . 16.7 t80 -50.99 -32.09 20.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.689 -0.485 . . . . 2.25 109.689 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.403 ' CD1' ' HB3' ' A' ' 9' ' ' ASN . 0.2 OUTLIER -77.2 -55.33 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.058 -0.519 . . . . 1.74 110.096 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.25 -25.87 66.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.058 -0.519 . . . . 2.2000000000000002 111.384 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.2 -51.41 3.83 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.818 0.303 . . . . 1.8999999999999999 111.818 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -104.11 -76.19 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.995 -0.282 . . . . 1.1799999999999999 111.343 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.38 77.56 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.951 0.405 . . . . 1.6799999999999999 110.624 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 184' ' ' PRO . 1.0 OUTLIER -132.37 -69.23 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.894 -0.594 . . . . 2.6600000000000001 111.49 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 183' ' ' GLU . 6.6 Cg_endo -48.27 -32.53 19.8 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.087 1.858 . . . . 1.03 112.256 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' TRP . . . . . 0.479 ' CE3' HG12 ' A' ' 186' ' ' ILE . 3.0 t90 -79.31 -36.55 39.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.67000000000000004 111.123 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ILE . . . . . 0.479 HG12 ' CE3' ' A' ' 185' ' ' TRP . 1.9 mt -53.55 -52.27 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 CA-C-O 120.913 0.387 . . . . 1.2 110.594 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -67.26 -52.64 38.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.942 -0.572 . . . . 2.6699999999999999 110.796 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.54 -41.2 29.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.126 -0.488 . . . . 2.4100000000000001 111.096 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -67.42 -24.79 65.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 1.9299999999999999 110.87 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' GLY . . . . . . . . . . . . . . . 130.41 25.48 0.86 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.41999999999999998 112.97 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . 67.69 155.77 0.62 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.721 -0.752 . . . . 0.39000000000000001 113.405 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' TRP . . . . . . . . . . . . . 13.5 m95 -47.54 -31.16 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.246 -0.477 . . . . 0.81000000000000005 110.325 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -45.84 92.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 2.0899999999999999 110.058 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 1.2 m -54.03 -45.81 71.67 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.731 -0.47 . . . . 1.1100000000000001 109.731 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' PHE . . . . . 0.447 ' CZ ' ' CD1' ' A' ' 94' ' ' LEU . 0.7 OUTLIER -49.18 -50.62 37.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.795 -0.639 . . . . 2.2000000000000002 110.247 179.497 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' VAL . . . . . . . . . . . . . 2.1 t -51.71 -45.25 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 1.8600000000000001 111.176 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.44 -49.46 63.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 2.5299999999999998 111.781 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.89 -58.17 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.28 0.474 . . . . 2.0499999999999998 112.28 -178.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' TYR . . . . . 0.433 ' CZ ' ' HB2' ' A' ' 141' ' ' TRP . 3.2 m-85 -91.21 7.16 42.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.908 0.707 . . . . 1.8 112.908 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -49.03 175.65 0.03 OUTLIER Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.454 -0.879 . . . . 0.41999999999999998 112.754 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -45.42 -34.44 3.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.753 0.311 . . . . 3.04 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -61.45 -43.93 98.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.297 -0.41 . . . . 2.5699999999999998 110.848 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' ALA . . . . . . . . . . . . . . . -67.84 -68.89 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 1.1299999999999999 111.207 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' ALA . . . . . . . . . . . . . . . -47.67 -29.03 2.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 1.22 111.328 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -64.23 -61.56 2.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.377 -0.374 . . . . 1.22 111.07 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -48.21 -54.63 12.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 2.2999999999999998 110.942 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' SER . . . . . 0.412 ' HB2' ' CE1' ' B' ' 323' ' ' PHE . 40.8 t -50.81 -50.23 56.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 1.47 110.893 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.13 -29.47 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.289 -0.414 . . . . 4.21 111.064 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 7.3 ttpp -76.2 -28.84 57.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 3.1899999999999999 111.322 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -109.45 9.34 32.9 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.534 -0.841 . . . . 1.49 113.44 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -126.25 -48.15 1.59 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.201 0.5 . . . . 3.75 110.958 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -25.21 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 4.3700000000000001 111.319 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.47 -61.47 0.47 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.493 -0.322 . . . . 8.6600000000000001 111.492 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' LEU . . . . . . . . . . . . . 5.6 tt 76.94 -67.46 0.21 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.337 -0.392 . . . . 7.8700000000000001 111.017 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.26 -0.876 . . . . 9.3300000000000001 111.016 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.89 0.376 . . . . 4.5 111.203 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -155.09 92.33 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 2.9700000000000002 110.812 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.11 -50.87 12.07 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.127 -0.488 . . . . 4.1500000000000004 111.154 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' B' ' 305' ' ' ALA . . . -56.31 -106.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.273 -0.87 . . . . 1.21 110.784 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' ALA . . . . . 0.462 ' C ' ' O ' ' B' ' 304' ' ' ALA . . . 3.04 -72.79 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.635 0.976 . . . . 1.22 113.635 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 306' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' B' ' 304' ' ' ALA . 0.4 OUTLIER -49.31 -68.2 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.222 -0.445 . . . . 2.7799999999999998 111.017 179.179 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 307' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -66.07 -43.93 85.98 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.144 0.497 . . . . 4.54 110.462 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 308' ' ' TYR . . . . . 0.542 ' CE2' ' CE1' ' A' ' 150' ' ' PHE . 1.4 t80 -43.61 -49.29 7.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.868 . . . . 1.3200000000000001 110.913 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 309' ' ' GLY . . . . . . . . . . . . . . . -69.49 -41.89 75.17 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.857 -0.687 . . . . 0.81000000000000005 112.269 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 310' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -53.5 -54.09 42.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 3.46 110.685 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 311' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.23 -44.24 79.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 1.99 110.592 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 312' ' ' LEU . . . . . 0.45 ' CD1' ' CZ ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -63.28 -30.85 71.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 2.7000000000000002 110.891 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 313' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -61.72 -53.15 59.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 2.9900000000000002 110.969 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 314' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -48.36 -59.1 3.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.202 -0.454 . . . . 3.8500000000000001 110.746 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 315' ' ' MET . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 1.3 mtm -49.72 -32.9 14.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 1.8500000000000001 110.523 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -52.6 60.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 1.77 110.679 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 317' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -48.35 -44.2 34.22 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.052 -0.522 . . . . 1.8 110.424 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 318' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -79.4 -30.5 42.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.044 -0.525 . . . . 2.3599999999999999 110.698 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 319' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -48.87 -41.96 35.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.043 -0.526 . . . . 0.65000000000000002 110.823 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 320' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.73 149.81 14.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.119 -0.491 . . . . 1.8899999999999999 111.072 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 321' ' ' ASP . . . . . . . . . . . . . 1.1 t0 178.41 -37.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 1.97 111.036 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 322' ' ' SER . . . . . . . . . . . . . 51.8 m -96.78 -44.99 6.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 1.73 111.077 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 323' ' ' PHE . . . . . 0.422 ' N ' ' CD1' ' B' ' 323' ' ' PHE . 3.0 m-30 -53.32 -48.24 68.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.321 -0.399 . . . . 2.1800000000000002 110.888 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 324' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -72.23 132.41 44.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 3.3199999999999998 110.933 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 325' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.215 -0.898 . . . . 5.9199999999999999 110.901 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.848 0.356 . . . . 5.08 111.207 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.7 -47.97 9.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.443 . . . . 4.55 110.865 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -30.39 13.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 5.91 110.974 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -49.86 -28.33 6.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 1.91 111.665 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . 0.44 ' HE2' ' N ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -46.52 -30.63 2.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.321 -0.399 . . . . 2.53 110.849 -179.207 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.44 ' N ' ' HE2' ' A' ' 5' ' ' MET . 0.7 OUTLIER -50.91 -31.62 18.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.983 -0.553 . . . . 2.24 111.231 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -35.86 14.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.316 . . . . 2.79 110.847 -179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.8 m -80.65 -39.7 26.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 1.3 111.038 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.495 ' ND2' ' NE1' ' A' ' 192' ' ' TRP . 0.7 OUTLIER -72.86 -33.04 65.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.405 . . . . 2.29 111.837 -179.397 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.96 ' O ' HG13 ' A' ' 14' ' ' VAL . 9.0 tpt180 -56.65 -55.67 31.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.727 -0.471 . . . . 2.27 109.727 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.757 ' CD ' HG21 ' A' ' 39' ' ' THR . 0.7 OUTLIER -66.37 -25.72 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.132 0.492 . . . . 2.68 109.928 178.162 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.617 HD21 HG12 ' A' ' 90' ' ' VAL . 0.1 OUTLIER -61.83 -53.38 56.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.645 -0.872 . . . . 1.47 108.645 178.734 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.594 HG21 ' HB2' ' A' ' 175' ' ' ALA . 25.3 m -68.0 -38.9 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.147 -1.388 . . . . 1.45 111.636 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.96 HG13 ' O ' ' A' ' 10' ' ' ARG . 1.8 m -70.32 -36.29 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-O 120.928 0.394 . . . . 0.73 110.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -70.18 -55.34 9.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.935 -0.575 . . . . 1.93 110.641 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 149' ' ' SER . 2.6 t80 -52.82 -49.06 66.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 1.53 110.223 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.678 ' CD1' ' HB2' ' A' ' 171' ' ' ALA . 19.7 mt -50.23 -51.99 39.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.849 -0.614 . . . . 1.32 110.375 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.445 ' CB ' ' CD1' ' A' ' 28' ' ' TRP . 1.4 p -59.3 -41.92 90.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 1.29 110.728 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -31.92 42.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.984 0.421 . . . . 1.38 110.197 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -74.2 -45.99 44.76 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.992 -0.549 . . . . 1.48 111.034 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.981 HD13 HG22 ' A' ' 156' ' ' VAL . 3.8 mm? -56.09 -32.74 64.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.95 0.405 . . . . 0.93 110.184 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.73 -47.72 70.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.063 -0.517 . . . . 1.2 110.92 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -42.49 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 2.62 110.691 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.485 ' CG ' HG11 ' A' ' 156' ' ' VAL . 0.0 OUTLIER -88.58 1.5 54.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.085 -0.507 . . . . 2.77 111.752 179.726 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.9 47.0 90.16 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.405 -0.902 . . . . 1.0 112.047 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.869 ' CB ' HD12 ' A' ' 21' ' ' LEU . 7.0 m-85 -107.42 131.04 54.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.758 0.313 . . . . 0.95 110.391 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.411 ' O ' ' CE2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -72.1 87.68 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.467 -0.333 . . . . 1.49 111.294 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.445 ' CD1' ' CB ' ' A' ' 18' ' ' SER . 74.0 t-105 -58.1 -19.97 36.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.373 -0.376 . . . . 0.77 111.509 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.734 ' HA ' HG12 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -85.15 10.83 11.14 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.211 0.449 . . . . 1.77 112.211 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -113.44 15.9 18.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.614 0.245 . . . . 2.84 110.923 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.411 ' CE2' ' O ' ' A' ' 27' ' ' SER . 12.7 m-85 -126.16 -43.7 1.78 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.817 0.341 . . . . 1.36 110.83 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.47 -87.16 0.58 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.248 -0.433 . . . . 1.97 111.233 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 169.48 42.73 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.164 0.507 . . . . 2.86 110.83 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.734 HG12 ' HA ' ' A' ' 29' ' ' SER . 2.4 p -61.73 83.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.008 -0.542 . . . . 2.73 111.254 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.21 -74.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.137 -0.483 . . . . 4.49 110.899 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.87 -178.3 0.54 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 4.92 110.844 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -48.36 168.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 4.44 110.908 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.87 100.55 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 4.4 110.913 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.757 HG21 ' CD ' ' A' ' 11' ' ' GLU . 6.0 m -132.75 85.01 2.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.223 -0.444 . . . . 2.38 110.955 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.7 mt-10 61.37 155.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.201 -0.454 . . . . 3.66 110.88 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 40' ' ' GLU . . . 165.98 107.26 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.041 -0.527 . . . . 1.84 109.887 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -101.14 -3.64 0.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.496 2.797 . . . . 2.73 113.669 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -119.85 -62.71 1.46 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.836 0.351 . . . . 2.96 110.848 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.69 ' O ' HG23 ' A' ' 45' ' ' THR . . . -155.65 -82.33 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.717 . . . . 0.91 112.479 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 44' ' ' GLY . 0.8 OUTLIER -169.28 37.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.923 0.392 . . . . 1.51 110.673 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.901 ' O ' HG23 ' A' ' 90' ' ' VAL . 15.2 tt0 -49.53 -66.9 0.32 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.092 -0.504 . . . . 1.28 111.102 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -45.88 -41.47 11.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.213 -0.449 . . . . 0.7 111.226 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.508 ' CD ' HG22 ' A' ' 45' ' ' THR . 4.5 mt-10 -54.87 -59.71 4.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.489 -0.323 . . . . 2.45 110.603 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.5 -32.43 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.45 110.732 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 46' ' ' GLU . 22.7 t -65.11 -40.57 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.927 -0.579 . . . . 0.47 110.865 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -61.48 -57.08 13.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 1.01 110.628 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -54.42 -43.7 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 1.91 110.883 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -49.22 -51.65 31.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.43 110.746 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.685 HD12 ' CZ ' ' A' ' 195' ' ' PHE . 1.3 mp -64.3 -34.03 77.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.078 -0.51 . . . . 0.51 110.859 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -62.25 -48.04 81.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 3.25 110.926 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.89 -64.04 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 1.85 110.723 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.584 ' HB3' HG11 ' A' ' 145' ' ' VAL . . . -52.23 -41.74 63.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.35 110.636 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.427 ' N ' HG11 ' A' ' 145' ' ' VAL . . . -58.47 -30.95 65.76 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.712 -0.756 . . . . 0.5 111.967 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.565 ' O ' HD12 ' A' ' 103' ' ' LEU . 14.7 t70 -71.35 -35.67 71.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.018 0.437 . . . . 1.77 109.931 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.2 -39.87 91.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.737 -0.665 . . . . 2.02 110.629 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.751 ' CZ ' HD13 ' B' ' 312' ' ' LEU . 3.0 t80 -66.85 -56.15 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 1.36 110.85 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -54.63 -45.82 73.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 2.1 110.734 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.565 HD12 ' O ' ' A' ' 99' ' ' ASP . 0.2 OUTLIER -62.07 -30.59 71.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.125 -0.489 . . . . 1.99 110.853 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 -58.33 6.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 2.97 111.063 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -144.87 82.41 1.67 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.351 -0.386 . . . . 4.17 111.265 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -18.32 58.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 2.38 111.269 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -47.09 -55.4 8.41 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.882 0.372 . . . . 3.77 110.446 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -53.77 -29.75 41.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.139 -0.482 . . . . 1.03 110.283 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -90.12 52.34 2.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.902 -0.59 . . . . 1.11 110.664 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.1 t -116.61 -158.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 1.77 110.506 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -64.13 111.07 2.4 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.755 0.312 . . . . 2.22 110.573 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 116' ' ' LEU . 12.7 mt -97.81 -25.88 14.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 1.41 111.653 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.1 p -70.54 -26.04 63.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.342 -0.39 . . . . 0.63 111.411 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -27.93 61.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.516 -0.311 . . . . 1.51 111.048 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -79.95 -53.94 6.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 1.69 111.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' HB3' ' B' ' 304' ' ' ALA . 1.1 pt? -112.15 173.29 6.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.857 0.36 . . . . 1.41 111.162 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -90.11 108.41 19.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 2.71 110.982 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 4.4 mm -106.03 101.17 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 1.03 111.017 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.82 151.9 57.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.75 110.982 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PRO . . . . . 0.562 ' HA ' HD11 ' A' ' 166' ' ' LEU . 52.8 Cg_exo -52.22 106.12 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 1.02 112.292 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 116.43 -27.61 7.95 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.756 -0.735 . . . . 1.16 112.531 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.66 -28.07 13.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.705 0.288 . . . . 1.18 111.08 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -47.42 -30.57 3.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.392 -0.367 . . . . 0.56 111.23 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' TYR . . . . . 0.446 ' CG ' ' N ' ' A' ' 125' ' ' GLN . 0.4 OUTLIER -58.85 -42.32 89.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 1.21 110.508 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.446 ' N ' ' CG ' ' A' ' 124' ' ' TYR . 1.0 OUTLIER -54.99 -49.12 72.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 2.54 110.494 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.593 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.9 OUTLIER -59.66 -62.93 1.51 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.916 -0.584 . . . . 1.62 110.908 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . 0.492 ' HA ' HG13 ' A' ' 130' ' ' VAL . 1.4 t80 -43.31 -57.59 2.94 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.023 -0.535 . . . . 1.6 111.518 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.16 -41.94 38.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.847 0.356 . . . . 2.51 110.56 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.557 ' HB2' ' HB1' ' B' ' 305' ' ' ALA . 46.3 mm-40 -68.54 -68.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 2.13 110.615 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 126' ' ' SER . 0.2 OUTLIER -43.76 -51.45 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 116.075 -0.511 . . . . 1.11 111.061 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.509 HG21 ' CE1' ' A' ' 177' ' ' TYR . 0.3 OUTLIER -59.26 -33.81 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.54 111.322 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -62.11 -67.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 1.91 111.009 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -64.21 -14.69 57.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 2.52 112.001 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 24.9 tp -80.26 -44.93 18.81 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.729 0.27 . . . . 1.47 111.729 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' PHE . . . . . 0.593 ' HD2' HG22 ' A' ' 139' ' ' VAL . 72.1 m-85 -116.95 23.19 12.08 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.975 0.361 . . . . 1.31 111.975 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.76 -75.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.786 0.326 . . . . 4.69 111.11 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -115.62 75.91 0.97 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 3.14 111.09 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 138.15 141.23 4.14 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.641 -0.79 . . . . 1.5 112.779 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' VAL . . . . . 0.593 HG22 ' HD2' ' A' ' 135' ' ' PHE . 88.3 t -130.76 -80.38 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.683 0.278 . . . . 1.52 110.556 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 57.6 160.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.188 0.518 . . . . 1.68 111.783 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.493 ' HE1' HD13 ' A' ' 198' ' ' LEU . 10.7 m95 -55.76 -28.88 58.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.952 -0.567 . . . . 0.33 110.338 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -57.52 -59.57 10.59 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.069 -0.586 . . . . 0.29 113.02 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -61.3 -31.54 71.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.853 0.326 . . . . 1.95 110.801 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.643 HD11 ' CZ3' ' A' ' 185' ' ' TRP . 1.3 mm -59.31 -59.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 0.64 111.179 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' VAL . . . . . 0.584 HG11 ' HB3' ' A' ' 97' ' ' ALA . 70.6 t -52.43 -48.6 45.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.795 0.331 . . . . 1.35 111.106 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.09 75.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.41 111.131 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 174' ' ' MET . 13.9 t80 -61.6 -43.81 98.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 1.65 110.809 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.545 ' CE2' HG12 ' A' ' 13' ' ' VAL . 15.7 m-85 -60.67 -52.74 63.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 1.06 110.604 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . 0.426 ' HA ' ' CE1' ' A' ' 16' ' ' PHE . 1.4 t -60.82 -36.12 78.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.139 0.495 . . . . 0.73 109.971 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' PHE . . . . . 0.542 ' CE1' ' CE2' ' B' ' 308' ' ' TYR . 4.3 t80 -47.92 -66.89 0.33 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.459 -0.791 . . . . 3.53 110.447 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -58.55 -26.65 60.02 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.753 -0.737 . . . . 0.4 112.064 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLY . . . . . 0.579 ' HA2' HD23 ' A' ' 17' ' ' LEU . . . -57.26 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.691 -0.766 . . . . 0.37 112.271 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -61.04 -34.72 75.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.911 0.386 . . . . 0.46 110.861 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' LEU . . . . . 0.41 HD13 ' CD1' ' A' ' 112' ' ' LEU . 1.5 tp -65.59 -31.5 72.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 1.12 110.576 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.623 ' O ' HG22 ' A' ' 159' ' ' VAL . 0.0 OUTLIER -69.27 -56.97 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 1.22 110.894 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 156' ' ' VAL . . . . . 0.981 HG22 HD13 ' A' ' 21' ' ' LEU . 21.7 t -53.32 -32.07 19.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.329 -0.396 . . . . 1.01 110.605 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -43.96 84.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 1.81 110.702 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -59.77 3.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 1.32 110.691 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' VAL . . . . . 0.705 HG12 ' CG ' ' A' ' 164' ' ' GLN . 0.0 OUTLIER -46.93 -35.66 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.85 110.998 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -62.69 -28.26 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 1.75 111.348 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 27.32 3.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.345 . . . . 2.19 111.356 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 63.24 32.45 14.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.82 0.343 . . . . 2.18 110.925 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 3.7 mtm -132.33 87.82 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.77 110.731 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.705 ' CG ' HG12 ' A' ' 159' ' ' VAL . 3.1 mp0 -94.62 -20.12 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 2.13 111.612 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 78.4 t -48.94 -29.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.783 0.325 . . . . 0.77 111.18 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LEU . . . . . 0.562 HD11 ' HA ' ' A' ' 120' ' ' PRO . 1.4 mm? -79.69 -24.7 41.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.251 -0.431 . . . . 1.41 111.462 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' VAL . . . . . 0.454 ' CG2' HG13 ' A' ' 159' ' ' VAL . 45.1 t -52.96 -79.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.732 0.301 . . . . 0.41 111.43 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' SER . . . . . 0.446 ' N ' HG12 ' A' ' 167' ' ' VAL . 0.3 OUTLIER -51.64 -44.72 63.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 1.42 110.984 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.419 ' HB3' ' CZ2' ' A' ' 173' ' ' TRP . 7.5 mtt180 -52.9 -37.97 61.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 1.8 110.946 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ILE . . . . . 0.427 ' HA ' ' CE3' ' A' ' 173' ' ' TRP . 42.4 mt -74.89 -42.98 46.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.52 111.071 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ALA . . . . . 0.678 ' HB2' ' CD1' ' A' ' 17' ' ' LEU . . . -53.18 -47.76 68.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.291 -0.413 . . . . 0.49 110.821 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.83 97.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.135 -0.484 . . . . 0.59 110.856 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' TRP . . . . . 0.427 ' CE3' ' HA ' ' A' ' 170' ' ' ILE . 50.1 m0 -60.36 -42.22 95.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.63 111.092 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' MET . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 147' ' ' PHE . 42.8 mtp -63.79 -40.76 97.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 1.2 111.399 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' ALA . . . . . 0.594 ' HB2' HG21 ' A' ' 13' ' ' VAL . . . -74.16 -55.65 5.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.245 -0.434 . . . . 0.53 111.488 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 1.3 m -54.66 -29.68 53.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.606 -0.27 . . . . 0.5 111.055 -179.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' TYR . . . . . 0.572 ' CE2' HD13 ' A' ' 182' ' ' LEU . 16.7 t80 -50.99 -32.09 20.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.689 -0.485 . . . . 1.36 109.689 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.549 HD12 ' O ' ' A' ' 175' ' ' ALA . 0.2 OUTLIER -77.2 -55.33 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.096 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ASN . . . . . 0.459 ' ND2' ' O ' ' A' ' 179' ' ' ASN . 0.0 OUTLIER -60.25 -25.87 66.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.058 -0.519 . . . . 1.67 111.384 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.2 -51.41 3.83 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.818 0.303 . . . . 1.9 111.818 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -104.11 -76.19 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.995 -0.282 . . . . 0.95 111.343 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.603 HD23 HD13 ' A' ' 144' ' ' ILE . 7.3 mp -67.38 77.56 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.951 0.405 . . . . 1.31 110.624 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLU . . . . . 0.437 ' HB3' ' CD ' ' A' ' 184' ' ' PRO . 1.0 OUTLIER -132.37 -69.23 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.894 -0.594 . . . . 2.66 111.49 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 184' ' ' PRO . . . . . 0.437 ' CD ' ' HB3' ' A' ' 183' ' ' GLU . 6.6 Cg_endo -48.27 -32.53 19.8 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.087 1.858 . . . . 0.76 112.256 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' TRP . . . . . 0.643 ' CZ3' HD11 ' A' ' 144' ' ' ILE . 3.0 t90 -79.31 -36.55 39.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.56 111.123 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ILE . . . . . 0.507 HG12 ' CE3' ' A' ' 185' ' ' TRP . 1.9 mt -53.55 -52.27 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 CA-C-O 120.913 0.387 . . . . 0.55 110.594 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -67.26 -52.64 38.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.942 -0.572 . . . . 2.18 110.796 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.54 -41.2 29.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.126 -0.488 . . . . 2.41 111.096 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -67.42 -24.79 65.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 1.48 110.87 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 190' ' ' GLY . . . . . . . . . . . . . . . 130.41 25.48 0.86 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.39 112.97 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . 67.69 155.77 0.62 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.721 -0.752 . . . . 0.35 113.405 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' TRP . . . . . 0.495 ' NE1' ' ND2' ' A' ' 9' ' ' ASN . 13.5 m95 -47.54 -31.16 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.246 -0.477 . . . . 0.69 110.325 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -45.84 92.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 2.09 110.058 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 1.2 m -54.03 -45.81 71.67 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.731 -0.47 . . . . 0.34 109.731 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' PHE . . . . . 0.685 ' CZ ' HD12 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -49.18 -50.62 37.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.795 -0.639 . . . . 1.29 110.247 179.497 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 196' ' ' VAL . . . . . 0.45 ' CG2' HG22 ' A' ' 90' ' ' VAL . 2.1 t -51.71 -45.25 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 1.19 111.176 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.44 -49.46 63.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 2.53 111.781 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' LEU . . . . . 0.693 ' O ' ' HB2' ' A' ' 203' ' ' ALA . 0.2 OUTLIER -61.89 -58.17 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.28 0.474 . . . . 1.45 112.28 -178.901 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 199' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 141' ' ' TRP . 3.2 m-85 -91.21 7.16 42.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.908 0.707 . . . . 1.07 112.908 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -49.03 175.65 0.03 OUTLIER Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.454 -0.879 . . . . 0.36 112.754 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 205' ' ' ALA . 2.4 t30 -45.42 -34.44 3.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.753 0.311 . . . . 2.43 111.31 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 202' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -61.45 -43.93 98.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.297 -0.41 . . . . 2.11 110.848 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' ALA . . . . . 0.693 ' HB2' ' O ' ' A' ' 198' ' ' LEU . . . -67.84 -68.89 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.47 111.207 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 204' ' ' ALA . . . . . . . . . . . . . . . -47.67 -29.03 2.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.47 111.328 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 201' ' ' ASN . . . -64.23 -61.56 2.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.377 -0.374 . . . . 0.61 111.07 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -48.21 -54.63 12.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 2.3 110.942 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' SER . . . . . 0.434 ' HB2' ' CE1' ' B' ' 323' ' ' PHE . 40.8 t -50.81 -50.23 56.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 1.13 110.893 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.13 -29.47 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.289 -0.414 . . . . 3.52 111.064 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 7.3 ttpp -76.2 -28.84 57.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 2.8 111.322 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -109.45 9.34 32.9 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.534 -0.841 . . . . 1.49 113.44 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -126.25 -48.15 1.59 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.201 0.5 . . . . 3.14 110.958 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -25.21 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 4.37 111.319 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.47 -61.47 0.47 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.493 -0.322 . . . . 8.08 111.492 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 214' ' ' LEU . . . . . 0.612 HD23 ' O ' ' A' ' 215' ' ' GLU . 5.6 tt 76.94 -67.46 0.21 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.337 -0.392 . . . . 7.51 111.017 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 215' ' ' GLU . . . . . 0.612 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.26 -0.876 . . . . 9.33 111.016 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 301' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.89 0.376 . . . . 3.99 111.203 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 302' ' ' LEU . . . . . 0.646 HD11 HD13 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -155.09 92.33 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 2.43 110.812 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 303' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.11 -50.87 12.07 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.127 -0.488 . . . . 3.23 111.154 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 304' ' ' ALA . . . . . 0.782 ' HB3' HD22 ' A' ' 116' ' ' LEU . . . -56.31 -106.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.273 -0.87 . . . . 1.21 110.784 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 305' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 129' ' ' GLN . . . 3.04 -72.79 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.635 0.976 . . . . 0.65 113.635 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 306' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' B' ' 304' ' ' ALA . 0.4 OUTLIER -49.31 -68.2 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.222 -0.445 . . . . 2.52 111.017 179.179 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 307' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -66.07 -43.93 85.98 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.144 0.497 . . . . 4.03 110.462 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 308' ' ' TYR . . . . . 0.593 ' CE2' HD22 ' A' ' 112' ' ' LEU . 1.4 t80 -43.61 -49.29 7.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.868 . . . . 0.84 110.913 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 309' ' ' GLY . . . . . . . . . . . . . . . -69.49 -41.89 75.17 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.857 -0.687 . . . . 0.75 112.269 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 310' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -53.5 -54.09 42.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 2.95 110.685 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 311' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.23 -44.24 79.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 1.99 110.592 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 312' ' ' LEU . . . . . 0.751 HD13 ' CZ ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -63.28 -30.85 71.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 2.08 110.891 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 313' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -61.72 -53.15 59.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 2.35 110.969 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 314' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -48.36 -59.1 3.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.202 -0.454 . . . . 3.26 110.746 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 315' ' ' MET . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 1.3 mtm -49.72 -32.9 14.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 1.3 110.523 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -52.6 60.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 1.28 110.679 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 317' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -48.35 -44.2 34.22 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.052 -0.522 . . . . 1.8 110.424 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 318' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -79.4 -30.5 42.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.044 -0.525 . . . . 2.36 110.698 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 319' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -48.87 -41.96 35.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.043 -0.526 . . . . 0.51 110.823 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 320' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.73 149.81 14.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.119 -0.491 . . . . 1.24 111.072 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 321' ' ' ASP . . . . . . . . . . . . . 1.1 t0 178.41 -37.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 1.97 111.036 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 322' ' ' SER . . . . . . . . . . . . . 51.8 m -96.78 -44.99 6.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 1.39 111.077 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 323' ' ' PHE . . . . . 0.531 ' CD1' ' HB1' ' A' ' 203' ' ' ALA . 3.0 m-30 -53.32 -48.24 68.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.321 -0.399 . . . . 1.28 110.888 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 324' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -72.23 132.41 44.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 2.91 110.933 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 325' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.215 -0.898 . . . . 5.48 110.901 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.328 0 CA-C-O 120.848 0.356 . . . . 5.0800000000000001 111.207 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.7 -47.97 9.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.443 . . . . 4.5499999999999998 110.865 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -50.77 -30.39 13.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.474 . . . . 5.9100000000000001 110.974 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -49.86 -28.33 6.37 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.204 -0.453 . . . . 1.9099999999999999 111.665 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 0.44 ' HE2' ' N ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -46.52 -30.63 2.32 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.321 -0.399 . . . . 2.5299999999999998 110.849 -179.207 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.44 ' N ' ' HE2' ' A' ' 5' ' ' MET . 0.7 OUTLIER -50.91 -31.62 18.14 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.983 -0.553 . . . . 2.2400000000000002 111.231 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -35.86 14.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.316 . . . . 2.79 110.847 -179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.8 m -80.65 -39.7 26.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.247 -0.433 . . . . 1.3 111.038 179.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.454 ' ND2' HD13 ' A' ' 178' ' ' LEU . 1.0 OUTLIER -72.86 -33.04 65.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.31 -0.405 . . . . 2.29 111.837 -179.397 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.96 ' O ' HG13 ' A' ' 14' ' ' VAL . 9.0 tpt180 -56.65 -55.67 31.03 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.727 -0.471 . . . . 2.27 109.727 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.757 ' CD ' HG21 ' A' ' 39' ' ' THR . 0.7 OUTLIER -66.37 -25.72 66.93 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.132 0.492 . . . . 2.6800000000000002 109.928 178.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.617 HD21 HG12 ' A' ' 90' ' ' VAL . 0.1 OUTLIER -61.83 -53.38 56.66 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 108.645 -0.872 . . . . 1.47 108.645 178.734 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.594 HG21 ' HB2' ' A' ' 175' ' ' ALA . 25.3 m -68.0 -38.9 80.65 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 114.147 -1.388 . . . . 1.45 111.636 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.96 HG13 ' O ' ' A' ' 10' ' ' ARG . 1.8 m -70.32 -36.29 66.43 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.211 0 CA-C-O 120.928 0.394 . . . . 0.72999999999999998 110.286 178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -70.18 -55.34 9.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.935 -0.575 . . . . 1.9299999999999999 110.641 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.426 ' CE1' ' HA ' ' A' ' 149' ' ' SER . 2.6 t80 -52.82 -49.06 66.42 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 1.53 110.223 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.678 ' CD1' ' HB2' ' A' ' 171' ' ' ALA . 19.7 mt -50.23 -51.99 39.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.849 -0.614 . . . . 1.3200000000000001 110.375 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.445 ' CB ' ' CD1' ' A' ' 28' ' ' TRP . 1.4 p -59.3 -41.92 90.11 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.028 -0.533 . . . . 1.29 110.728 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.88 -31.92 42.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.984 0.421 . . . . 1.3799999999999999 110.197 179.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -74.2 -45.99 44.76 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.992 -0.549 . . . . 1.48 111.034 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.981 HD13 HG22 ' A' ' 156' ' ' VAL . 3.8 mm? -56.09 -32.74 64.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.95 0.405 . . . . 0.93000000000000005 110.184 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -53.73 -47.72 70.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.063 -0.517 . . . . 1.2 110.92 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.03 -42.49 80.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 2.6200000000000001 110.691 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.485 ' CG ' HG11 ' A' ' 156' ' ' VAL . 0.0 OUTLIER -88.58 1.5 54.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.085 -0.507 . . . . 2.77 111.752 179.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 63.9 47.0 90.16 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.405 -0.902 . . . . 1.0 112.047 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.869 ' CB ' HD12 ' A' ' 21' ' ' LEU . 7.0 m-85 -107.42 131.04 54.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.758 0.313 . . . . 0.94999999999999996 110.391 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.411 ' O ' ' CE2' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -72.1 87.68 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.467 -0.333 . . . . 1.49 111.294 -179.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.445 ' CD1' ' CB ' ' A' ' 18' ' ' SER . 74.0 t-105 -58.1 -19.97 36.29 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.373 -0.376 . . . . 0.77000000000000002 111.509 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.734 ' HA ' HG12 ' A' ' 34' ' ' VAL . 0.8 OUTLIER -85.15 10.83 11.14 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.211 0.449 . . . . 1.77 112.211 -179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -113.44 15.9 18.99 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.614 0.245 . . . . 2.8399999999999999 110.923 179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.411 ' CE2' ' O ' ' A' ' 27' ' ' SER . 12.7 m-85 -126.16 -43.7 1.78 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 120.817 0.341 . . . . 1.3600000000000001 110.83 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -114.47 -87.16 0.58 Allowed 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.248 -0.433 . . . . 1.97 111.233 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 169.48 42.73 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.164 0.507 . . . . 2.8599999999999999 110.83 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.734 HG12 ' HA ' ' A' ' 29' ' ' SER . 2.4 p -61.73 83.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 116.008 -0.542 . . . . 2.73 111.254 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -48.21 -74.59 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.137 -0.483 . . . . 4.4900000000000002 110.899 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.87 -178.3 0.54 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 4.9199999999999999 110.844 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -48.36 168.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 4.4400000000000004 110.908 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.87 100.55 0.05 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 4.4000000000000004 110.913 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.757 HG21 ' CD ' ' A' ' 11' ' ' GLU . 6.0 m -132.75 85.01 2.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.223 -0.444 . . . . 2.3799999999999999 110.955 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.7 mt-10 61.37 155.32 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.201 -0.454 . . . . 3.6600000000000001 110.88 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB2' ' O ' ' A' ' 40' ' ' GLU . . . 165.98 107.26 0.03 OUTLIER Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.041 -0.527 . . . . 1.8400000000000001 109.887 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -101.14 -3.64 0.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.496 2.797 . . . . 2.73 113.669 -178.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -119.85 -62.71 1.46 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.836 0.351 . . . . 2.96 110.848 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.69 ' O ' HG23 ' A' ' 45' ' ' THR . . . -155.65 -82.33 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.717 . . . . 0.91000000000000003 112.479 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.69 HG23 ' O ' ' A' ' 44' ' ' GLY . 0.8 OUTLIER -169.28 37.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.923 0.392 . . . . 1.51 110.673 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.901 ' O ' HG23 ' A' ' 90' ' ' VAL . 15.2 tt0 -49.53 -66.9 0.32 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.092 -0.504 . . . . 1.28 111.102 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 m -45.88 -41.47 11.34 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.213 -0.449 . . . . 0.69999999999999996 111.226 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.508 ' CD ' HG22 ' A' ' 45' ' ' THR . 4.5 mt-10 -54.87 -59.71 4.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.489 -0.323 . . . . 2.4500000000000002 110.603 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -59.5 -32.43 70.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.45000000000000001 110.732 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.901 HG23 ' O ' ' A' ' 46' ' ' GLU . 22.7 t -65.11 -40.57 89.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.927 -0.579 . . . . 0.46999999999999997 110.865 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 mtmt -61.48 -57.08 13.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.146 -0.479 . . . . 1.01 110.628 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -54.42 -43.7 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.043 -0.526 . . . . 1.9099999999999999 110.883 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -49.22 -51.65 31.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.42999999999999999 110.746 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.685 HD12 ' CZ ' ' A' ' 195' ' ' PHE . 1.3 mp -64.3 -34.03 77.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.078 -0.51 . . . . 0.51000000000000001 110.859 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 ttt-85 -62.25 -48.04 81.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 3.25 110.926 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.89 -64.04 1.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 1.8500000000000001 110.723 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.584 ' HB3' HG11 ' A' ' 145' ' ' VAL . . . -52.23 -41.74 63.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.34999999999999998 110.636 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.427 ' N ' HG11 ' A' ' 145' ' ' VAL . . . -58.47 -30.95 65.76 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.712 -0.756 . . . . 0.5 111.967 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.565 ' O ' HD12 ' A' ' 103' ' ' LEU . 14.7 t70 -71.35 -35.67 71.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.018 0.437 . . . . 1.77 109.931 179.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.2 -39.87 91.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.737 -0.665 . . . . 2.02 110.629 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.751 ' CZ ' HD13 ' B' ' 312' ' ' LEU . 3.0 t80 -66.85 -56.15 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 1.3600000000000001 110.85 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -54.63 -45.82 73.82 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 2.1000000000000001 110.734 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.565 HD12 ' O ' ' A' ' 99' ' ' ASP . 0.2 OUTLIER -62.07 -30.59 71.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.125 -0.489 . . . . 1.99 110.853 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.72 -58.33 6.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 2.9700000000000002 111.063 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -144.87 82.41 1.67 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.351 -0.386 . . . . 4.1699999999999999 111.265 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -18.32 58.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 2.3799999999999999 111.269 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -47.09 -55.4 8.41 Favored 'General case' 0 C--O 1.231 0.11 0 CA-C-O 120.882 0.372 . . . . 3.77 110.446 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -53.77 -29.75 41.49 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.139 -0.482 . . . . 1.03 110.283 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -90.12 52.34 2.24 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.902 -0.59 . . . . 1.1100000000000001 110.664 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 6.1 t -116.61 -158.73 0.7 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.025 -0.534 . . . . 1.77 110.506 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -64.13 111.07 2.4 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.755 0.312 . . . . 2.2200000000000002 110.573 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.715 ' O ' HD23 ' A' ' 116' ' ' LEU . 12.7 mt -97.81 -25.88 14.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.267 -0.424 . . . . 1.4099999999999999 111.653 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 3.1 p -70.54 -26.04 63.38 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.342 -0.39 . . . . 0.63 111.411 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -27.93 61.24 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.516 -0.311 . . . . 1.51 111.048 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -79.95 -53.94 6.27 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 1.6899999999999999 111.257 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' HB3' ' B' ' 304' ' ' ALA . 1.1 pt? -112.15 173.29 6.43 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.857 0.36 . . . . 1.4099999999999999 111.162 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -90.11 108.41 19.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.157 -0.474 . . . . 2.71 110.982 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 4.4 mm -106.03 101.17 12.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.161 -0.472 . . . . 1.03 111.017 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.82 151.9 57.76 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.75 110.982 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.562 ' HA ' HD11 ' A' ' 166' ' ' LEU . 52.8 Cg_exo -52.22 106.12 0.13 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.662 2.241 . . . . 1.02 112.292 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . 116.43 -27.61 7.95 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.756 -0.735 . . . . 1.1599999999999999 112.531 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.66 -28.07 13.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.705 0.288 . . . . 1.1799999999999999 111.08 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -47.42 -30.57 3.42 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.392 -0.367 . . . . 0.56000000000000005 111.23 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.446 ' CG ' ' N ' ' A' ' 125' ' ' GLN . 0.4 OUTLIER -58.85 -42.32 89.04 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.376 . . . . 1.21 110.508 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.446 ' N ' ' CG ' ' A' ' 124' ' ' TYR . 1.0 OUTLIER -54.99 -49.12 72.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 2.54 110.494 179.671 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.593 ' O ' HG12 ' A' ' 130' ' ' VAL . 0.9 OUTLIER -59.66 -62.93 1.51 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.916 -0.584 . . . . 1.6200000000000001 110.908 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . 0.492 ' HA ' HG13 ' A' ' 130' ' ' VAL . 1.4 t80 -43.31 -57.59 2.94 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 116.023 -0.535 . . . . 1.6000000000000001 111.518 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -49.16 -41.94 38.04 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.847 0.356 . . . . 2.5099999999999998 110.56 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.557 ' HB2' ' HB1' ' B' ' 305' ' ' ALA . 46.3 mm-40 -68.54 -68.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 2.1299999999999999 110.615 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 126' ' ' SER . 0.2 OUTLIER -43.76 -51.45 1.43 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 116.075 -0.511 . . . . 1.1100000000000001 111.061 -179.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.509 HG21 ' CE1' ' A' ' 177' ' ' TYR . 0.3 OUTLIER -59.26 -33.81 51.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.095 -0.502 . . . . 0.54000000000000004 111.322 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -62.11 -67.12 0.44 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.445 -0.343 . . . . 1.9099999999999999 111.009 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -64.21 -14.69 57.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 2.52 112.001 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 24.9 tp -80.26 -44.93 18.81 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.729 0.27 . . . . 1.47 111.729 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' PHE . . . . . 0.593 ' HD2' HG22 ' A' ' 139' ' ' VAL . 72.1 m-85 -116.95 23.19 12.08 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.975 0.361 . . . . 1.3100000000000001 111.975 -179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.76 -75.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.786 0.326 . . . . 4.6900000000000004 111.11 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -115.62 75.91 0.97 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 3.1400000000000001 111.09 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 138.15 141.23 4.14 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.641 -0.79 . . . . 1.5 112.779 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' VAL . . . . . 0.593 HG22 ' HD2' ' A' ' 135' ' ' PHE . 88.3 t -130.76 -80.38 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.683 0.278 . . . . 1.52 110.556 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 57.6 160.23 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.188 0.518 . . . . 1.6799999999999999 111.783 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.493 ' HE1' HD13 ' A' ' 198' ' ' LEU . 10.7 m95 -55.76 -28.88 58.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.952 -0.567 . . . . 0.33000000000000002 110.338 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLY . . . . . . . . . . . . . . . -57.52 -59.57 10.59 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.069 -0.586 . . . . 0.28999999999999998 113.02 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.2 mtt85 -61.3 -31.54 71.37 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.853 0.326 . . . . 1.95 110.801 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.643 HD11 ' CZ3' ' A' ' 185' ' ' TRP . 1.3 mm -59.31 -59.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 0.64000000000000001 111.179 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . 0.584 HG11 ' HB3' ' A' ' 97' ' ' ALA . 70.6 t -52.43 -48.6 45.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-O 120.795 0.331 . . . . 1.3500000000000001 111.106 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -61.92 -34.09 75.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.40999999999999998 111.131 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 174' ' ' MET . 13.9 t80 -61.6 -43.81 98.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 1.6499999999999999 110.809 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.545 ' CE2' HG12 ' A' ' 13' ' ' VAL . 15.7 m-85 -60.67 -52.74 63.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 1.0600000000000001 110.604 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . 0.426 ' HA ' ' CE1' ' A' ' 16' ' ' PHE . 1.4 t -60.82 -36.12 78.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.139 0.495 . . . . 0.72999999999999998 109.971 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' PHE . . . . . 0.542 ' CE1' ' CE2' ' B' ' 308' ' ' TYR . 4.3 t80 -47.92 -66.89 0.33 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.459 -0.791 . . . . 3.5299999999999998 110.447 179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLY . . . . . . . . . . . . . . . -58.55 -26.65 60.02 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.753 -0.737 . . . . 0.40000000000000002 112.064 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLY . . . . . 0.579 ' HA2' HD23 ' A' ' 17' ' ' LEU . . . -57.26 -63.25 5.48 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.691 -0.766 . . . . 0.37 112.271 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -61.04 -34.72 75.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.911 0.386 . . . . 0.46000000000000002 110.861 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' LEU . . . . . 0.41 HD13 ' CD1' ' A' ' 112' ' ' LEU . 1.5 tp -65.59 -31.5 72.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 1.1200000000000001 110.576 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.623 ' O ' HG22 ' A' ' 159' ' ' VAL . 0.0 OUTLIER -69.27 -56.97 5.99 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.285 -0.416 . . . . 1.22 110.894 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' VAL . . . . . 0.981 HG22 HD13 ' A' ' 21' ' ' LEU . 21.7 t -53.32 -32.07 19.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.329 -0.396 . . . . 1.01 110.605 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -43.96 84.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.007 -0.542 . . . . 1.8100000000000001 110.702 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -59.77 3.12 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.35 -0.386 . . . . 1.3200000000000001 110.691 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' VAL . . . . . 0.705 HG12 ' CG ' ' A' ' 164' ' ' GLN . 0.0 OUTLIER -46.93 -35.66 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 CA-C-N 116.119 -0.491 . . . . 0.84999999999999998 110.998 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -62.69 -28.26 69.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 1.75 111.348 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.38 27.32 3.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.442 -0.345 . . . . 2.1899999999999999 111.356 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 63.24 32.45 14.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.82 0.343 . . . . 2.1800000000000002 110.925 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 3.7 mtm -132.33 87.82 2.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.77000000000000002 110.731 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.705 ' CG ' HG12 ' A' ' 159' ' ' VAL . 3.1 mp0 -94.62 -20.12 19.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 2.1299999999999999 111.612 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 78.4 t -48.94 -29.41 2.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.783 0.325 . . . . 0.77000000000000002 111.18 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LEU . . . . . 0.562 HD11 ' HA ' ' A' ' 120' ' ' PRO . 1.4 mm? -79.69 -24.7 41.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.251 -0.431 . . . . 1.4099999999999999 111.462 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' VAL . . . . . 0.454 ' CG2' HG13 ' A' ' 159' ' ' VAL . 45.1 t -52.96 -79.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.732 0.301 . . . . 0.40999999999999998 111.43 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' SER . . . . . 0.446 ' N ' HG12 ' A' ' 167' ' ' VAL . 0.3 OUTLIER -51.64 -44.72 63.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 1.4199999999999999 110.984 -179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.419 ' HB3' ' CZ2' ' A' ' 173' ' ' TRP . 7.5 mtt180 -52.9 -37.97 61.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.207 -0.452 . . . . 1.8 110.946 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ILE . . . . . 0.427 ' HA ' ' CE3' ' A' ' 173' ' ' TRP . 42.4 mt -74.89 -42.98 46.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.124 -0.489 . . . . 0.52000000000000002 111.071 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ALA . . . . . 0.678 ' HB2' ' CD1' ' A' ' 17' ' ' LEU . . . -53.18 -47.76 68.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.291 -0.413 . . . . 0.48999999999999999 110.821 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -63.99 -40.83 97.26 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.135 -0.484 . . . . 0.58999999999999997 110.856 179.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' TRP . . . . . 0.427 ' CE3' ' HA ' ' A' ' 170' ' ' ILE . 50.1 m0 -60.36 -42.22 95.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.185 -0.461 . . . . 0.63 111.092 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' MET . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 147' ' ' PHE . 42.8 mtp -63.79 -40.76 97.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.287 -0.415 . . . . 1.2 111.399 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' ALA . . . . . 0.594 ' HB2' HG21 ' A' ' 13' ' ' VAL . . . -74.16 -55.65 5.83 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.245 -0.434 . . . . 0.53000000000000003 111.488 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' THR . . . . . 0.452 HG23 HD22 ' A' ' 179' ' ' ASN . 1.3 m -54.66 -29.68 53.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.606 -0.27 . . . . 0.5 111.055 -179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' TYR . . . . . 0.572 ' CE2' HD13 ' A' ' 182' ' ' LEU . 16.7 t80 -50.99 -32.09 20.05 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.689 -0.485 . . . . 1.3600000000000001 109.689 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.549 HD12 ' O ' ' A' ' 175' ' ' ALA . 0.2 OUTLIER -77.2 -55.33 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.058 -0.519 . . . . 1.1100000000000001 110.096 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ASN . . . . . 0.452 HD22 HG23 ' A' ' 176' ' ' THR . 0.1 OUTLIER -60.25 -25.87 66.01 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.058 -0.519 . . . . 1.6699999999999999 111.384 179.764 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.2 -51.41 3.83 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.818 0.303 . . . . 1.8999999999999999 111.818 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -104.11 -76.19 0.6 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.995 -0.282 . . . . 0.94999999999999996 111.343 -179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.603 HD23 HD13 ' A' ' 144' ' ' ILE . 7.3 mp -67.38 77.56 0.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.951 0.405 . . . . 1.3100000000000001 110.624 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLU . . . . . 0.437 ' HB3' ' CD ' ' A' ' 184' ' ' PRO . 1.0 OUTLIER -132.37 -69.23 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.351 0 CA-C-N 115.894 -0.594 . . . . 2.6600000000000001 111.49 179.925 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' PRO . . . . . 0.437 ' CD ' ' HB3' ' A' ' 183' ' ' GLU . 6.6 Cg_endo -48.27 -32.53 19.8 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 122.087 1.858 . . . . 0.76000000000000001 112.256 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' TRP . . . . . 0.643 ' CZ3' HD11 ' A' ' 144' ' ' ILE . 3.0 t90 -79.31 -36.55 39.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.444 -0.344 . . . . 0.56000000000000005 111.123 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ILE . . . . . 0.507 HG12 ' CE3' ' A' ' 185' ' ' TRP . 1.9 mt -53.55 -52.27 34.73 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.13 0 CA-C-O 120.913 0.387 . . . . 0.55000000000000004 110.594 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' GLN . . . . . . . . . . . . . 23.0 mt-30 -67.26 -52.64 38.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.942 -0.572 . . . . 2.1800000000000002 110.796 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -48.54 -41.2 29.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.126 -0.488 . . . . 2.4100000000000001 111.096 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -67.42 -24.79 65.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.348 -0.387 . . . . 1.48 110.87 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' GLY . . . . . . . . . . . . . . . 130.41 25.48 0.86 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.784 -0.722 . . . . 0.39000000000000001 112.97 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' GLY . . . . . . . . . . . . . . . 67.69 155.77 0.62 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.721 -0.752 . . . . 0.34999999999999998 113.405 179.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' TRP . . . . . 0.455 ' HZ2' HD22 ' A' ' 178' ' ' LEU . 13.5 m95 -47.54 -31.16 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.246 -0.477 . . . . 0.68999999999999995 110.325 179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -45.84 92.68 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.047 -0.524 . . . . 2.0899999999999999 110.058 179.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' THR . . . . . . . . . . . . . 1.2 m -54.03 -45.81 71.67 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.731 -0.47 . . . . 0.34000000000000002 109.731 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' PHE . . . . . 0.685 ' CZ ' HD12 ' A' ' 94' ' ' LEU . 0.7 OUTLIER -49.18 -50.62 37.11 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.795 -0.639 . . . . 1.29 110.247 179.497 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' VAL . . . . . 0.45 ' CG2' HG22 ' A' ' 90' ' ' VAL . 2.1 t -51.71 -45.25 37.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.797 -0.638 . . . . 1.1899999999999999 111.176 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -67.44 -49.46 63.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.135 -0.484 . . . . 2.5299999999999998 111.781 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' LEU . . . . . 0.693 ' O ' ' HB2' ' A' ' 203' ' ' ALA . 0.2 OUTLIER -61.89 -58.17 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.28 0.474 . . . . 1.45 112.28 -178.901 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 141' ' ' TRP . 3.2 m-85 -91.21 7.16 42.13 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.908 0.707 . . . . 1.0700000000000001 112.908 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' GLY . . . . . . . . . . . . . . . -49.03 175.65 0.03 OUTLIER Glycine 0 C--N 1.332 0.354 0 C-N-CA 120.454 -0.879 . . . . 0.35999999999999999 112.754 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 205' ' ' ALA . 2.4 t30 -45.42 -34.44 3.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.753 0.311 . . . . 2.4300000000000002 111.31 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -61.45 -43.93 98.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.297 -0.41 . . . . 2.1099999999999999 110.848 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' ALA . . . . . 0.693 ' HB2' ' O ' ' A' ' 198' ' ' LEU . . . -67.84 -68.89 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.46999999999999997 111.207 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' ALA . . . . . . . . . . . . . . . -47.67 -29.03 2.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.45 . . . . 0.46999999999999997 111.328 -179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 201' ' ' ASN . . . -64.23 -61.56 2.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.377 -0.374 . . . . 0.60999999999999999 111.07 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -48.21 -54.63 12.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.083 -0.508 . . . . 2.2999999999999998 110.942 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' SER . . . . . 0.434 ' HB2' ' CE1' ' B' ' 323' ' ' PHE . 40.8 t -50.81 -50.23 56.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.435 . . . . 1.1299999999999999 110.893 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -63.13 -29.47 70.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.289 -0.414 . . . . 3.52 111.064 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' LYS . . . . . . . . . . . . . 7.3 ttpp -76.2 -28.84 57.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 2.7999999999999998 111.322 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -109.45 9.34 32.9 Favored Glycine 0 CA--C 1.522 0.502 0 C-N-CA 120.534 -0.841 . . . . 1.49 113.44 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' GLN . . . . . . . . . . . . . 10.3 tm0? -126.25 -48.15 1.59 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.201 0.5 . . . . 3.1400000000000001 110.958 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -25.21 12.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 4.3700000000000001 111.319 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 75.47 -61.47 0.47 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-N 116.493 -0.322 . . . . 8.0800000000000001 111.492 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' LEU . . . . . 0.612 HD23 ' O ' ' A' ' 215' ' ' GLU . 5.6 tt 76.94 -67.46 0.21 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.337 -0.392 . . . . 7.5099999999999998 111.017 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' GLU . . . . . 0.612 ' O ' HD23 ' A' ' 214' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.26 -0.876 . . . . 9.3300000000000001 111.016 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.89 0.376 . . . . 3.9900000000000002 111.203 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' LEU . . . . . 0.646 HD11 HD13 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -155.09 92.33 1.43 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.091 -0.504 . . . . 2.4300000000000002 110.812 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -77.11 -50.87 12.07 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.127 -0.488 . . . . 3.23 111.154 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' ALA . . . . . 0.782 ' HB3' HD22 ' A' ' 116' ' ' LEU . . . -56.31 -106.75 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 118.273 -0.87 . . . . 1.21 110.784 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' ALA . . . . . 0.557 ' HB1' ' HB2' ' A' ' 129' ' ' GLN . . . 3.04 -72.79 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 113.635 0.976 . . . . 0.65000000000000002 113.635 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 306' ' ' GLN . . . . . 0.424 ' N ' ' O ' ' B' ' 304' ' ' ALA . 0.4 OUTLIER -49.31 -68.2 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.222 -0.445 . . . . 2.52 111.017 179.179 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 307' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 -66.07 -43.93 85.98 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.144 0.497 . . . . 4.0300000000000002 110.462 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 308' ' ' TYR . . . . . 0.593 ' CE2' HD22 ' A' ' 112' ' ' LEU . 1.4 t80 -43.61 -49.29 7.64 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.289 -0.868 . . . . 0.83999999999999997 110.913 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 309' ' ' GLY . . . . . . . . . . . . . . . -69.49 -41.89 75.17 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.857 -0.687 . . . . 0.75 112.269 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 310' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -53.5 -54.09 42.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.909 0.385 . . . . 2.9500000000000002 110.685 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 311' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.23 -44.24 79.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 1.99 110.592 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 312' ' ' LEU . . . . . 0.751 HD13 ' CZ ' ' A' ' 101' ' ' PHE . 0.2 OUTLIER -63.28 -30.85 71.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.151 -0.477 . . . . 2.0800000000000001 110.891 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 313' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -61.72 -53.15 59.94 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 2.3500000000000001 110.969 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 314' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 -48.36 -59.1 3.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.202 -0.454 . . . . 3.2599999999999998 110.746 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 315' ' ' MET . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 101' ' ' PHE . 1.3 mtm -49.72 -32.9 14.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.121 -0.491 . . . . 1.3 110.523 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 316' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.44 -52.6 60.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 1.28 110.679 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 317' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -48.35 -44.2 34.22 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.052 -0.522 . . . . 1.8 110.424 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 318' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -79.4 -30.5 42.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.044 -0.525 . . . . 2.3599999999999999 110.698 179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 319' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -48.87 -41.96 35.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.043 -0.526 . . . . 0.51000000000000001 110.823 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 320' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -111.73 149.81 14.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.119 -0.491 . . . . 1.24 111.072 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 321' ' ' ASP . . . . . . . . . . . . . 1.1 t0 178.41 -37.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 1.97 111.036 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 322' ' ' SER . . . . . . . . . . . . . 51.8 m -96.78 -44.99 6.83 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.272 -0.422 . . . . 1.3899999999999999 111.077 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 323' ' ' PHE . . . . . 0.531 ' CD1' ' HB1' ' A' ' 203' ' ' ALA . 3.0 m-30 -53.32 -48.24 68.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.321 -0.399 . . . . 1.28 110.888 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 324' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -72.23 132.41 44.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 2.9100000000000001 110.933 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 325' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.215 -0.898 . . . . 5.4800000000000004 110.901 179.995 . . . . . . . . 1 1 . 1 stop_ save_