data_2eq0_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 2eq0 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.765 0.235 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -76.01 146.46 39.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -126.71 119.57 27.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.907 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 14.1 t -62.83 118.92 8.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.923 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 -80.02 -12.19 59.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -69.14 -49.26 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.3 p -117.13 -40.4 3.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 117.12 21.76 4.4 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.455 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -89.78 130.98 35.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 0.0 110.918 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.58 149.91 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.114 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -135.09 150.34 50.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -62.14 -65.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -101.89 -179.83 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.907 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -78.71 -42.16 29.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.6 m -52.09 -43.64 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -57.42 -35.82 70.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.65 -33.99 58.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.55 -55.17 37.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.105 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -32.47 72.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -67.76 -38.73 83.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -55.18 -26.48 39.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.883 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.4 mt -54.2 -36.4 63.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 12.8 tt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.889 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.204 0 CA-C-O 120.757 0.232 . . . . 0.0 112.358 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -70.15 139.36 52.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -118.4 109.15 15.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -51.95 120.78 5.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.872 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -86.01 4.72 36.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -90.05 -43.75 10.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 p -122.8 -35.55 3.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.853 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.93 24.36 5.22 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.505 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -91.99 127.29 37.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.814 0.34 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.07 149.76 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -139.62 156.99 46.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.41 -74.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.878 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 44.1 mtt85 -106.67 155.18 19.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -51.93 -33.35 36.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -53.33 -35.75 60.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.841 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -73.02 -32.07 64.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.8 tp -78.07 -33.09 51.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.76 -53.56 53.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -27.31 66.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -66.47 -41.92 88.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -56.82 -24.48 51.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 79.5 mt -55.94 -26.64 48.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.2 tt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.149 179.825 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.173 0 CA-C-O 120.851 0.271 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -84.52 119.5 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -100.41 113.53 26.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.881 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -57.37 121.13 9.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -85.5 4.03 37.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.82 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -90.06 -44.68 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.909 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.43 -35.12 3.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.45 22.63 5.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.483 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -90.92 126.07 35.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 26.3 t -91.5 147.87 4.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -137.09 135.07 37.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -53.2 -62.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -96.53 170.81 8.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -79.08 -30.39 43.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.12 -43.36 87.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.839 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -59.02 -27.08 65.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.877 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.8 tp -83.53 -36.71 23.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.52 -52.77 60.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -70.73 -26.63 63.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -68.66 -39.79 80.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.853 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -55.75 -25.86 42.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.9 mt -54.52 -35.02 62.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.9 tt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.161 0 CA-C-O 120.809 0.254 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -86.33 144.72 27.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 13.3 tttm -121.87 126.15 48.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -69.94 120.95 16.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -84.09 1.85 42.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.817 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -89.38 -43.42 10.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.5 p -122.64 -35.8 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.72 23.18 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.511 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttm -89.14 127.83 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.815 0.34 . . . . 0.0 110.936 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 29.1 t -93.86 146.16 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -131.76 156.18 46.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -72.49 -60.9 2.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.829 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.1 mmt-85 -96.92 -177.54 3.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -88.02 -38.46 15.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.5 p -55.79 -44.16 77.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -55.48 -37.73 68.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.82 -38.33 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.896 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.17 -53.69 49.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.09 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -65.19 -28.04 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -69.64 -41.23 75.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.826 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -55.79 -25.92 43.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.7 mt -54.58 -33.63 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.6 tt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.179 179.825 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.809 0.254 . . . . 0.0 112.371 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -82.23 138.89 34.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -117.79 130.28 56.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.0 t -74.69 121.14 21.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -82.7 0.78 41.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -88.84 -41.67 12.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.871 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 12.1 p -125.09 -38.22 2.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.832 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.54 23.09 5.81 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.459 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -89.85 113.89 25.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.891 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.6 t -85.33 144.83 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.099 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -125.77 171.88 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.863 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -84.42 -52.7 5.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -110.01 177.45 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.835 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -80.0 -42.75 23.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.8 t -52.1 -43.35 63.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -57.37 -37.16 72.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 13.0 tp -77.41 -35.42 54.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.991 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.87 -52.62 56.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -68.69 -26.15 65.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.9 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.79 -39.07 76.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.798 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -54.92 -26.67 37.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.944 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.33 -40.7 68.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.911 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.6 tt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.091 179.86 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.152 0 CA-C-O 120.763 0.234 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -79.31 141.97 36.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -124.47 108.93 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.887 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 3.7 t -51.99 118.19 3.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.874 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.0 t-160 -84.26 0.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.852 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.05 -40.4 12.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.7 p -122.93 -35.61 3.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 108.81 25.19 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.526 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -92.07 126.69 37.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 23.7 t -91.47 148.68 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.085 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -135.21 162.56 32.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -78.77 -63.61 1.37 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 40.4 mmm-85 -99.33 167.13 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -69.74 -34.06 73.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.1 m -61.07 -46.94 88.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -52.36 -32.11 36.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 9.7 tp -82.07 -34.9 29.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.961 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.79 -53.96 51.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -62.78 -27.26 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.82 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -72.61 -38.05 67.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -56.25 -25.31 47.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 55.2 mt -55.32 -28.94 57.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.9 tt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 179.87 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.77 0.237 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -75.79 141.93 42.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 56.0 tttt -120.8 109.84 15.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.897 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.3 t -51.97 118.45 3.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -84.15 2.41 39.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -89.96 -41.12 11.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.6 p -123.99 -36.41 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.62 5.54 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -90.87 129.18 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 0.0 110.854 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.12 149.99 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.113 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -141.36 148.78 40.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -55.07 -72.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.858 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -100.85 -175.14 2.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -86.36 -32.83 20.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.851 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.38 -33.87 55.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -74.09 -37.53 64.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.874 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 tp -73.1 -35.34 66.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.78 -49.69 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.093 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -74.2 -25.85 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -70.95 -22.29 62.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -74.26 -20.5 60.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 43.5 mt -66.29 -38.97 89.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 10.7 tt . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.14 179.85 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--O 1.231 0.165 0 CA-C-O 120.754 0.231 . . . . 0.0 112.311 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -70.51 136.33 49.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.941 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -115.53 111.28 20.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.863 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -54.02 120.88 6.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -85.73 4.3 37.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.869 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -89.99 -46.44 8.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.899 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.88 -34.17 3.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.78 23.61 5.55 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.483 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -90.48 126.9 36.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.829 0.347 . . . . 0.0 110.873 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 23.8 t -92.3 149.34 4.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.138 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -140.97 139.98 34.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.5 ttt-85 -52.37 -66.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -103.01 169.39 8.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -72.77 -32.72 65.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 88.7 p -52.09 -37.96 55.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -70.1 -34.75 73.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.98 -31.23 58.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.946 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -58.12 -56.67 19.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.58 -26.78 67.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -67.22 -40.15 86.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -55.91 -25.66 43.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.924 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 68.9 mt -54.76 -33.42 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.7 tt . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 179.789 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 N--CA 1.466 -0.13 0 CA-C-O 120.802 0.251 . . . . 0.0 112.345 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -71.37 145.92 49.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.863 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -126.46 122.55 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -62.66 120.8 11.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -85.38 3.97 37.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.04 -45.78 8.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.942 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.3 p -120.52 -33.26 3.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.26 5.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -94.41 126.33 39.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.811 0.338 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 43.2 t -93.2 147.33 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.151 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -132.89 173.17 11.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -75.64 -73.26 0.27 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.846 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.53 160.59 15.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.0 -36.48 50.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.0 m -54.3 -49.95 68.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -56.24 -29.75 61.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.4 tp -81.88 -36.48 28.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.909 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.87 -51.87 64.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -65.4 -27.23 68.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -72.35 -40.14 67.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -56.01 -25.42 44.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.0 mt -55.33 -28.84 56.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 179.842 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.755 0.231 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -77.83 142.01 38.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.924 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -121.4 126.38 49.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 17.9 t -66.67 115.2 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.911 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -77.62 -5.93 52.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.0 -54.77 5.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.7 p -111.2 -36.7 5.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.34 27.22 3.99 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -95.45 127.0 41.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.6 150.02 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.109 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -134.48 -177.18 4.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -90.17 -73.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.58 164.34 12.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -65.12 -31.0 71.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 20.9 t -61.56 -46.03 91.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -55.89 -34.25 65.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.8 tp -80.36 -40.3 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.956 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.77 -38.57 56.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.98 -25.95 36.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -70.56 -28.89 65.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.73 -24.83 67.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.866 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.41 -44.02 75.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.939 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 11.8 tt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 179.828 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.14 0 CA-C-O 120.779 0.241 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -76.55 137.97 39.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -120.63 119.77 33.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.928 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -61.37 120.7 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -85.04 3.62 37.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.882 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -89.98 -44.03 10.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.2 p -122.7 -35.89 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 24.37 5.54 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.48 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -90.92 127.0 36.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.897 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 39.0 t -92.47 147.48 5.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.075 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -131.7 170.92 14.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.863 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -81.85 -65.98 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 45.3 mtp85 -106.73 156.47 18.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.841 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -51.92 -42.17 62.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.8 t -52.41 -46.8 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -55.05 -31.12 60.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.81 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 11.5 tp -82.89 -31.92 27.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.14 -51.66 69.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -65.3 -28.72 69.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -69.53 -39.28 77.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -56.77 -24.64 51.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.919 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 53.6 mt -55.89 -26.04 45.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.4 tt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.875 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.796 0.248 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -79.61 147.05 32.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -119.46 110.44 16.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.8 t -52.87 118.13 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -83.98 2.23 39.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.92 -42.42 11.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.56 -35.31 3.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.861 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.18 22.39 6.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.486 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -91.2 129.6 37.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 26.1 t -96.41 148.87 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.106 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -130.34 -177.36 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -82.88 -58.48 2.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.874 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -126.58 169.72 12.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.836 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -53.79 -45.8 70.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 60.6 m -52.36 -52.29 54.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -55.01 -27.89 47.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 9.7 tp -84.88 -31.11 23.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.9 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.094 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -55.78 -27.37 50.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -78.47 -36.4 45.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -55.7 -25.9 42.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 58.2 mt -54.78 -32.1 59.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.913 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 11.8 tt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.086 179.863 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.796 0.249 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -78.22 146.86 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 50.3 tttt -125.54 122.04 35.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.4 t -62.92 119.01 8.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -83.82 2.07 40.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -90.06 -42.87 10.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 23.0 p -121.99 -34.9 3.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 109.52 23.49 6.26 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.523 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -90.73 127.14 36.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.96 149.82 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.127 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -135.38 162.2 33.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 44.9 ttm-85 -70.56 -56.71 5.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -116.47 179.79 3.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.82 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -81.8 -26.53 34.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 62.3 p -60.89 -38.79 86.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -69.58 -39.12 77.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.876 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.15 -37.69 69.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.76 -45.97 63.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -77.58 -26.11 50.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.859 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -68.32 -26.9 65.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -67.59 -25.92 66.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.916 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.19 -43.31 70.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 10.9 tt . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 179.898 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.231 0.149 0 CA-C-O 120.798 0.249 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -77.59 143.53 38.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -122.01 120.13 33.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.2 119.06 8.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -83.28 -0.1 48.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -87.42 -42.88 12.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.5 p -122.58 -36.19 2.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.841 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.4 21.72 6.42 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.494 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.7 mttm -88.51 127.05 35.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 25.3 t -90.96 148.71 4.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -136.46 143.03 43.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -56.56 -64.24 0.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.882 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -103.47 -177.1 3.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.933 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -85.54 -32.46 22.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -54.67 -41.69 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.831 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -64.43 -39.03 93.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 12.2 tp -71.75 -39.0 70.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -53.41 -48.71 68.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.115 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -72.75 -26.37 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.87 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -68.45 -37.65 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -56.09 -26.0 47.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.6 mt -53.62 -43.91 69.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.897 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.174 179.818 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.755 0.231 . . . . 0.0 112.316 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -74.7 137.37 42.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.916 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -117.28 128.21 54.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.866 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.68 119.25 13.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -82.98 1.23 40.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -88.75 -44.2 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.8 p -122.11 -35.03 3.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 21.67 6.62 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.47 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -88.05 124.32 33.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.7 t -92.14 149.56 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.115 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -130.19 -175.87 3.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 -28.46 6.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 56.9 mtt-85 -122.59 136.69 54.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -53.87 -34.97 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 65.7 m -64.97 -40.11 94.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.866 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 39.1 m170 -59.16 -32.4 69.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 12.8 tp -78.72 -35.06 45.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.33 -51.8 67.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.087 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -66.57 -28.21 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -70.04 -40.81 74.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -56.08 -25.31 44.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.34 -33.59 63.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 12.8 tt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.824 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.761 0.234 . . . . 0.0 112.323 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -85.29 142.13 29.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -121.05 131.26 54.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.899 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 6.2 t -70.69 120.03 15.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.864 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -85.32 -0.3 54.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.91 -34.58 16.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 9.1 p -128.6 -39.36 1.65 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.65 22.29 5.79 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 15.9 mtmm -92.64 124.89 36.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.826 0.346 . . . . 0.0 110.885 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 42.1 t -94.39 146.73 6.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.119 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -124.48 -175.85 3.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.78 -49.82 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.849 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -119.34 148.22 43.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -52.0 -39.84 60.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.4 p -56.5 -39.31 73.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.815 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -68.0 -30.44 69.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 13.1 tp -80.67 -39.18 27.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.12 -48.16 76.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.137 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 37.0 mmm-85 -63.22 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -74.55 -39.12 62.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.898 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -55.85 -25.55 42.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.05 -31.95 61.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 179.847 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.134 0 CA-C-O 120.796 0.248 . . . . 0.0 112.365 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -77.23 143.34 39.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.919 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -123.74 111.2 15.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.8 t -51.98 120.19 5.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -85.77 4.44 36.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -90.08 -45.33 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 21.2 p -121.88 -34.73 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.19 23.97 5.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.507 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -90.21 129.43 36.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -95.71 149.91 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -137.41 157.77 45.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.867 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -63.7 -72.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -101.8 178.28 4.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -75.57 -35.13 60.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.0 p -52.23 -50.72 61.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -58.15 -38.87 77.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.71 -28.95 65.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.75 11.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.087 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -59.54 -26.3 65.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -83.33 -18.71 38.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.32 -17.54 51.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 10.6 mt -95.7 26.27 4.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 10.1 tt . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.133 179.858 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.171 0 CA-C-O 120.77 0.237 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -78.2 147.94 34.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.947 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -128.98 112.09 13.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.913 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.2 t -57.4 120.61 8.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -81.8 -12.81 58.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -69.39 -45.27 69.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.874 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 6.9 p -119.3 -42.0 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.23 23.93 4.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.481 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -91.77 137.41 32.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.798 0.332 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.24 150.11 5.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -135.0 161.99 33.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -62.01 -73.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -113.44 -176.25 2.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.838 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -70.0 -36.94 75.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 -37.99 68.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -68.29 -45.46 72.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.841 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.8 tp -67.41 -32.46 73.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.0 -53.9 36.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.112 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 22.4 mmt-85 -64.22 -26.26 68.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -77.37 -23.94 50.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.841 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -72.91 -10.32 59.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.23 25.16 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.889 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.3 tt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.877 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.252 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -76.16 138.48 40.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.936 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -119.27 129.89 55.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.31 119.29 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.917 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -79.46 -7.63 58.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.849 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.4 -49.09 17.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.937 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.1 p -117.2 -40.35 3.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.79 21.41 4.63 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.46 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -88.46 128.09 35.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.815 0.34 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.81 146.85 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.129 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -127.02 -176.42 3.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -94.03 -67.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -105.58 150.99 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -52.0 -30.05 23.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.9 t -58.28 -49.89 75.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.859 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -57.41 -44.09 84.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 9.0 tp -67.36 -32.39 73.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.898 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.04 -54.63 27.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.064 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.57 -26.05 68.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -79.43 -18.73 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.847 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -79.49 -16.77 55.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 12.7 mt -95.67 25.96 4.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 179.839 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.811 0.254 . . . . 0.0 112.31 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -66.28 141.87 57.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.905 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -127.79 109.73 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.897 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.6 t -53.17 119.37 4.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -81.1 -16.39 53.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.837 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.68 -47.19 82.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 7.5 p -118.07 -41.74 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.88 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.61 27.04 2.92 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.2 mttm -95.75 132.27 41.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.823 0.344 . . . . 0.0 110.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.57 147.05 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.147 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -129.66 139.39 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.849 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -52.09 -44.68 64.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.877 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -135.59 170.03 16.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.867 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -67.58 -36.81 81.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.926 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 4.9 p -52.11 -34.95 46.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.865 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -77.63 -34.86 53.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.5 tp -73.03 -28.68 62.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.37 -56.96 15.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.108 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -60.52 -26.05 66.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -79.73 -24.02 41.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -71.8 -9.75 58.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 14.1 mt -98.82 24.64 7.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.6 tt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.17 179.834 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 60.5 m -60.49 140.68 57.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 94.0 p -115.04 165.81 12.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.892 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 111.18 108.64 3.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.511 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 4.2 p -113.04 150.15 32.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.842 0.353 . . . . 0.0 110.853 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.9 p -96.58 54.31 1.34 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.853 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 76.1 -132.47 12.86 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 9.9 t -65.1 -25.82 67.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.149 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 60.06 -156.96 28.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.502 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -168.96 159.28 9.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.875 0.369 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.25 73.78 10.91 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.559 0.695 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 129.39 17.55 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.74 2.293 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -76.01 146.46 39.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -126.71 119.57 27.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.907 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 14.1 t -62.83 118.92 8.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.923 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 -80.02 -12.19 59.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -69.14 -49.26 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.3 p -117.13 -40.4 3.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 117.12 21.76 4.4 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.455 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -89.78 130.98 35.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 0.0 110.918 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.58 149.91 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.114 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -135.09 150.34 50.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -62.14 -65.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -101.89 -179.83 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.907 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -78.71 -42.16 29.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.6 m -52.09 -43.64 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -57.42 -35.82 70.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 11.8 tp -76.65 -33.99 58.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.55 -55.17 37.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.105 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -32.47 72.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -67.76 -38.73 83.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -55.18 -26.48 39.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.883 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.4 mt -54.2 -36.4 63.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 12.8 tt -63.42 -25.67 38.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -96.83 -67.16 0.86 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 3.6 t -104.25 152.69 21.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.126 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -140.91 82.09 0.24 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -115.83 99.94 7.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.886 0.374 . . . . 0.0 110.895 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -116.46 71.82 4.95 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.589 0.709 . . . . 0.0 110.902 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -46.59 1.17 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.714 2.276 . . . . 0.0 112.323 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 2.0 t -69.3 105.39 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.842 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 134.41 75.19 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.523 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 151.89 68.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -105.27 -59.39 1.76 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.858 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 10.0 p -62.24 -50.39 71.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 119.126 -0.819 . . . . 0.0 112.461 -179.977 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 8.7 t -114.44 61.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.869 0.366 . . . . 0.0 110.887 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.2 m -103.0 160.84 14.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.86 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -53.07 -38.18 55.43 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.7 t -147.64 157.83 43.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.835 0.35 . . . . 0.0 110.889 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 27.7 t -115.31 -56.71 2.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.842 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 147.99 -104.09 0.28 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.489 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 5.6 p -87.03 -52.54 5.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 111.125 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 83.33 62.46 1.8 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.463 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -119.86 76.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -127.85 71.4 78.29 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.563 0.697 . . . . 0.0 110.917 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 111.35 2.78 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.663 2.242 . . . . 0.0 112.358 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -70.15 139.36 52.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -118.4 109.15 15.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -51.95 120.78 5.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.872 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -86.01 4.72 36.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -90.05 -43.75 10.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 p -122.8 -35.55 3.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.853 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.93 24.36 5.22 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.505 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -91.99 127.29 37.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.814 0.34 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.07 149.76 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -139.62 156.99 46.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.41 -74.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.878 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 44.1 mtt85 -106.67 155.18 19.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -51.93 -33.35 36.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -53.33 -35.75 60.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.841 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -73.02 -32.07 64.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.8 tp -78.07 -33.09 51.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.76 -53.56 53.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -27.31 66.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 73.7 t60 -66.47 -41.92 88.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -56.82 -24.48 51.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 79.5 mt -55.94 -26.64 48.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.2 tt -76.6 -25.55 16.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.149 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -90.03 -31.39 17.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 7.8 t -159.37 145.53 16.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.13 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -130.62 125.26 4.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.554 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -103.13 49.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 0.0 110.888 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -167.62 71.65 0.94 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.577 0.704 . . . . 0.0 110.924 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 179.31 3.78 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.387 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 21.4 p -84.6 -177.8 6.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.889 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -137.6 167.59 24.74 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.523 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -43.48 2.58 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.274 . . . . 0.0 112.308 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 6.2 t -115.62 138.55 50.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 7.4 p 53.37 28.84 7.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.886 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.099 -0.834 . . . . 0.0 112.495 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.435 -0.266 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.6 m -103.69 136.64 43.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.903 0.382 . . . . 0.0 110.835 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 54.6 p -71.27 -34.49 70.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.849 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -94.71 150.23 19.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.468 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 87.4 p -141.53 156.5 45.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.879 0.371 . . . . 0.0 110.816 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 27.7 p -98.56 98.76 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.904 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.13 129.41 5.41 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.479 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.64 107.69 19.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.13 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -171.35 -115.37 0.35 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.499 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -114.05 109.18 18.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 110.858 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.04 73.63 0.54 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.572 0.701 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 161.2 46.83 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.695 2.263 . . . . 0.0 112.312 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -84.52 119.5 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -100.41 113.53 26.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.881 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -57.37 121.13 9.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -85.5 4.03 37.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.82 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -90.06 -44.68 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.909 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.43 -35.12 3.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.45 22.63 5.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.483 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -90.92 126.07 35.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 26.3 t -91.5 147.87 4.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.182 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -137.09 135.07 37.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -53.2 -62.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -96.53 170.81 8.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -79.08 -30.39 43.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.12 -43.36 87.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.839 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -59.02 -27.08 65.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.877 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.8 tp -83.53 -36.71 23.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.52 -52.77 60.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -70.73 -26.63 63.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.8 t60 -68.66 -39.79 80.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.853 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -55.75 -25.86 42.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.9 mt -54.52 -35.02 62.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.9 tt -65.63 -25.4 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -95.63 -63.46 1.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 40.7 p -52.49 114.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -73.76 109.21 2.73 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.454 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -160.17 154.23 23.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.9 0.381 . . . . 0.0 110.889 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -117.81 72.85 8.55 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.568 0.699 . . . . 0.0 110.892 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 82.94 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.71 2.273 . . . . 0.0 112.333 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.9 t -80.26 147.78 31.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.86 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -96.26 -174.46 35.87 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.539 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -34.29 14.75 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.609 2.206 . . . . 0.0 112.357 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 5.0 p -112.25 36.04 3.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.856 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.3 t 59.21 44.53 15.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.901 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.494 -179.982 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.464 -0.254 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 8.0 m -149.96 166.96 28.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.386 . . . . 0.0 110.836 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 12.9 p -163.45 146.69 10.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.888 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -101.41 65.74 0.48 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.493 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 34.7 m -85.18 -30.92 23.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.924 0.393 . . . . 0.0 110.893 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 29.4 t -74.53 137.04 42.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.94 56.37 1.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.466 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 71.7 p -58.95 147.41 34.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.125 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 145.46 -57.38 0.52 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.48 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -110.1 100.32 9.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -159.05 68.4 3.29 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.68 28.56 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.704 2.269 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 34.7 m-85 -86.33 144.72 27.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 13.3 tttm -121.87 126.15 48.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -69.94 120.95 16.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -84.09 1.85 42.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.817 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -89.38 -43.42 10.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.5 p -122.64 -35.8 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.72 23.18 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.511 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttm -89.14 127.83 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.815 0.34 . . . . 0.0 110.936 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 29.1 t -93.86 146.16 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -131.76 156.18 46.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -72.49 -60.9 2.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.829 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.1 mmt-85 -96.92 -177.54 3.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -88.02 -38.46 15.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.5 p -55.79 -44.16 77.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -55.48 -37.73 68.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 16.9 tp -74.82 -38.33 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.896 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.17 -53.69 49.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.09 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -65.19 -28.04 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 80.4 t60 -69.64 -41.23 75.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.826 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -55.79 -25.92 43.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.7 mt -54.58 -33.63 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.6 tt -66.66 -26.12 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.179 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -93.26 -59.65 1.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.845 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 81.8 p -55.09 122.53 11.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.176 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -145.29 -150.65 5.25 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.467 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -117.99 118.59 32.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 110.904 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp 55.58 71.82 1.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.594 0.711 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -18.98 36.83 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.749 2.3 . . . . 0.0 112.347 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 23.0 t -123.87 35.68 4.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.879 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 65.82 -179.81 10.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.75 143.25 50.3 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.715 2.277 . . . . 0.0 112.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 34.5 t -143.72 159.99 41.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.897 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.4 t -96.03 -71.13 0.69 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.865 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 CA-C-O 119.133 -0.815 . . . . 0.0 112.494 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.481 -0.247 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 62.2 m -115.7 -179.71 3.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.872 0.367 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.7 t -81.21 165.99 21.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.8 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -150.63 138.85 6.89 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.523 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.3 t -118.75 59.6 0.82 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.927 0.394 . . . . 0.0 110.885 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.0 t -103.04 42.23 1.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.827 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -158.81 125.79 1.57 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.492 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 4.2 p -134.91 105.96 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 0.0 111.127 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -152.72 168.72 31.73 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -109.63 -28.15 9.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.906 0.384 . . . . 0.0 110.892 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -167.32 72.85 1.0 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.62 0.724 . . . . 0.0 110.899 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 134.09 27.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.678 2.252 . . . . 0.0 112.371 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -82.23 138.89 34.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.926 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -117.79 130.28 56.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.0 t -74.69 121.14 21.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -82.7 0.78 41.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -88.84 -41.67 12.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.871 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 12.1 p -125.09 -38.22 2.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.832 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.54 23.09 5.81 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.459 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -89.85 113.89 25.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.891 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.6 t -85.33 144.83 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.099 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -125.77 171.88 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.863 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -84.42 -52.7 5.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -110.01 177.45 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.835 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -80.0 -42.75 23.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.8 t -52.1 -43.35 63.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -57.37 -37.16 72.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 13.0 tp -77.41 -35.42 54.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.991 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.87 -52.62 56.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -68.69 -26.15 65.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.9 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.79 -39.07 76.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.798 180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -54.92 -26.67 37.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.944 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.33 -40.7 68.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.911 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.6 tt -57.88 -24.65 23.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -100.19 -69.57 0.77 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.89 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 7.8 t -94.78 155.73 16.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.153 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -150.4 55.84 0.47 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.458 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -105.09 69.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.958 0.409 . . . . 0.0 110.923 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -145.98 72.85 13.56 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.568 0.699 . . . . 0.0 110.937 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 -42.69 3.28 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.727 2.285 . . . . 0.0 112.348 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 13.4 m -76.83 130.96 38.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.823 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -59.66 -174.0 0.75 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.471 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 149.01 66.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.252 . . . . 0.0 112.366 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.1 p -107.0 165.36 11.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 9.6 t -105.18 145.5 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.862 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 CA-C-O 119.148 -0.807 . . . . 0.0 112.475 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 82.7 p -74.48 130.12 39.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.84 0.352 . . . . 0.0 110.902 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 41.3 t -118.88 56.44 0.9 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.843 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 179.15 176.74 47.16 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.527 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 4.1 t -151.85 155.58 38.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.85 0.357 . . . . 0.0 110.85 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 35.7 m -137.25 129.18 29.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.85 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -86.08 -60.36 1.76 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.468 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 10.4 t -168.15 155.25 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.124 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 160.26 -177.28 36.77 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.47 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -122.39 116.75 24.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.934 0.397 . . . . 0.0 110.885 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.4 tmtt? -151.32 71.32 8.4 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.562 0.696 . . . . 0.0 110.875 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 135.76 31.28 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.7 2.267 . . . . 0.0 112.342 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -79.31 141.97 36.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 69.4 tttt -124.47 108.93 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.887 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 3.7 t -51.99 118.19 3.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.874 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.0 t-160 -84.26 0.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.852 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.05 -40.4 12.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.7 p -122.93 -35.61 3.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 108.81 25.19 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.526 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -92.07 126.69 37.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 23.7 t -91.47 148.68 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.085 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -135.21 162.56 32.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -78.77 -63.61 1.37 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 40.4 mmm-85 -99.33 167.13 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -69.74 -34.06 73.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.1 m -61.07 -46.94 88.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -52.36 -32.11 36.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 9.7 tp -82.07 -34.9 29.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.961 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.79 -53.96 51.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -62.78 -27.26 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.82 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -72.61 -38.05 67.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -56.25 -25.31 47.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 55.2 mt -55.32 -28.94 57.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.9 tt -72.13 -26.57 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -91.02 -45.81 8.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.875 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 10.0 t -122.78 150.64 42.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.118 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.61 -137.41 7.76 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.468 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -148.28 117.49 6.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.964 0.411 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 13.3 tptp 53.99 71.69 1.3 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 83.31 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.33 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 41.2 t -73.23 -48.43 35.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 143.45 170.38 13.14 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.468 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 165.0 32.47 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.662 2.242 . . . . 0.0 112.346 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.5 m -93.56 56.42 2.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.874 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 2.1 m -71.51 112.01 7.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.855 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 119.127 -0.818 . . . . 0.0 112.493 -179.975 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.5 t -93.98 95.06 8.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.82 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 84.1 p -155.99 127.31 7.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 153.62 152.7 6.13 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.512 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 t -164.27 125.87 2.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.87 0.367 . . . . 0.0 110.856 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.1 p -80.87 114.91 20.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.875 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 146.87 155.67 6.63 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.529 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 8.7 t -151.56 152.6 33.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 111.144 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -108.32 -58.92 0.55 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.467 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.81 -175.9 6.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.402 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -174.03 68.51 0.32 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.635 0.731 . . . . 0.0 110.922 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 140.35 42.53 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.7 2.266 . . . . 0.0 112.332 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -75.79 141.93 42.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 56.0 tttt -120.8 109.84 15.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.897 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.3 t -51.97 118.45 3.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -84.15 2.41 39.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -89.96 -41.12 11.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.6 p -123.99 -36.41 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.62 5.54 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -90.87 129.18 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 0.0 110.854 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.12 149.99 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.113 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -141.36 148.78 40.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -55.07 -72.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.858 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -100.85 -175.14 2.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -86.36 -32.83 20.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.851 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.38 -33.87 55.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -74.09 -37.53 64.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.874 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 tp -73.1 -35.34 66.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.78 -49.69 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.093 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -74.2 -25.85 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -70.95 -22.29 62.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -74.26 -20.5 60.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 43.5 mt -66.29 -38.97 89.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 10.7 tt -56.72 -24.16 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.14 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -87.21 -25.95 23.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 61.2 p -100.13 166.69 10.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.101 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -139.16 100.65 0.29 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.506 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -60.76 110.0 1.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 0.0 110.856 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -161.37 72.89 2.57 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.603 0.716 . . . . 0.0 110.918 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -42.67 3.17 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.672 2.248 . . . . 0.0 112.333 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 2.9 p -55.91 170.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.855 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -176.42 -75.09 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.475 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 97.65 0.65 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.674 2.249 . . . . 0.0 112.397 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 9.0 p -54.43 162.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.836 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 82.5 p -107.77 34.46 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.785 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 CA-C-O 119.132 -0.815 . . . . 0.0 112.474 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.46 -0.256 . . . . 0.0 112.46 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 90.1 p -96.31 35.38 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 20.2 p -161.27 129.6 4.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.89 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -72.52 -147.81 0.78 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.496 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 27.2 p -99.85 87.79 3.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.862 0.363 . . . . 0.0 110.863 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 11.1 t -103.38 -68.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.865 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 141.77 141.83 3.99 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.483 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.3 m -79.5 -28.7 41.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.861 0.362 . . . . 0.0 111.182 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -82.09 -62.28 1.92 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.493 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 56.07 26.3 9.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.891 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.2 160.7 0.12 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.592 0.71 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.83 148.01 63.67 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.273 . . . . 0.0 112.311 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 43.1 m-85 -70.51 136.33 49.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.941 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 19.4 tttp -115.53 111.28 20.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.863 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -54.02 120.88 6.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -85.73 4.3 37.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.869 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -89.99 -46.44 8.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.899 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.88 -34.17 3.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.78 23.61 5.55 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.483 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -90.48 126.9 36.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.829 0.347 . . . . 0.0 110.873 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 23.8 t -92.3 149.34 4.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.138 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -140.97 139.98 34.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.5 ttt-85 -52.37 -66.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -103.01 169.39 8.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -72.77 -32.72 65.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 88.7 p -52.09 -37.96 55.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -70.1 -34.75 73.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.3 tp -75.98 -31.23 58.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.946 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -58.12 -56.67 19.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.58 -26.78 67.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -67.22 -40.15 86.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -55.91 -25.66 43.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.924 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 68.9 mt -54.76 -33.42 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.7 tt -67.46 -25.84 34.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -92.65 -57.32 2.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.879 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 8.9 t -117.7 129.95 56.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -153.49 -111.07 0.43 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.492 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -160.23 140.55 11.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp 53.17 73.29 0.96 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.62 0.724 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 121.36 8.05 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.742 2.294 . . . . 0.0 112.343 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 12.4 p -91.84 114.57 27.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.842 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -158.19 173.62 35.37 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.518 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -29.42 23.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.711 2.274 . . . . 0.0 112.326 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 80.6 p -59.95 168.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.834 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 21.0 m -128.41 148.43 50.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 CA-C-O 119.114 -0.826 . . . . 0.0 112.496 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 112.522 -0.231 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 15.0 m -82.39 172.18 13.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.865 0.364 . . . . 0.0 110.869 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 97.2 p -108.81 137.43 46.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.858 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -95.86 83.92 0.86 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.53 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 79.5 p -127.48 125.41 40.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.851 0.358 . . . . 0.0 110.893 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.0 p -76.32 89.66 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.832 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 71.71 -156.38 52.63 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.462 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.8 m -110.67 -51.34 2.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.831 0.348 . . . . 0.0 111.167 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 83.37 -92.79 1.68 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -103.54 143.7 32.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.876 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.82 69.63 64.89 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.602 0.715 . . . . 0.0 110.919 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 122.5 9.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.657 2.238 . . . . 0.0 112.345 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -71.37 145.92 49.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.863 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -126.46 122.55 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.918 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -62.66 120.8 11.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -85.38 3.97 37.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.04 -45.78 8.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.942 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.3 p -120.52 -33.26 3.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.26 5.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -94.41 126.33 39.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.811 0.338 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 43.2 t -93.2 147.33 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.151 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -132.89 173.17 11.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -75.64 -73.26 0.27 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.846 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.53 160.59 15.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.0 -36.48 50.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.0 m -54.3 -49.95 68.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -56.24 -29.75 61.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.4 tp -81.88 -36.48 28.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.909 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.87 -51.87 64.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -65.4 -27.23 68.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -72.35 -40.14 67.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -56.01 -25.42 44.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.0 mt -55.33 -28.84 56.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.0 tt -72.16 -26.66 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -92.75 -54.32 3.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 66.8 p -51.78 105.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.116 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.65 -34.47 6.93 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.502 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -139.67 171.94 13.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.905 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 18.8 mttm -127.5 160.7 59.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.545 0.688 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -45.96 1.39 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.361 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 7.3 m -68.31 157.77 34.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 156.25 -71.58 0.26 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 84.16 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.658 2.238 . . . . 0.0 112.319 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.4 p -96.79 146.07 25.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.823 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 4.0 m -166.24 155.98 11.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.869 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 CA-C-O 119.104 -0.831 . . . . 0.0 112.518 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.458 -0.257 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 4.4 p 55.41 28.29 11.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 0.0 110.879 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 5.3 m -112.4 79.62 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.831 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -105.66 102.18 1.95 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.495 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 12.8 m -100.1 163.64 12.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.866 0.365 . . . . 0.0 110.886 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 85.6 p -140.9 154.82 46.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.837 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 151.56 91.25 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.537 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.02 130.6 34.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 0.0 111.151 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 93.13 52.5 2.04 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.446 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -151.76 139.09 19.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.945 0.403 . . . . 0.0 110.886 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt 63.26 160.63 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.538 0.685 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 133.42 25.45 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.362 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -77.83 142.01 38.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.924 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -121.4 126.38 49.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 17.9 t -66.67 115.2 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.911 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -77.62 -5.93 52.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.0 -54.77 5.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.7 p -111.2 -36.7 5.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.34 27.22 3.99 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -95.45 127.0 41.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.6 150.02 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.109 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -134.48 -177.18 4.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -90.17 -73.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.58 164.34 12.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -65.12 -31.0 71.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 20.9 t -61.56 -46.03 91.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -55.89 -34.25 65.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.8 tp -80.36 -40.3 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.956 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.77 -38.57 56.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.98 -25.95 36.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 74.1 t60 -70.56 -28.89 65.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.839 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.73 -24.83 67.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.866 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.41 -44.02 75.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.939 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 11.8 tt -57.97 -22.65 19.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -90.38 -48.48 7.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.842 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 10.2 t -104.37 45.99 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.166 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -135.43 -172.31 12.66 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.469 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -112.55 -42.82 3.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.881 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 5.6 tppt? 63.24 73.06 0.52 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.541 0.686 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 117.75 5.27 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.682 2.255 . . . . 0.0 112.35 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 97.1 p -122.4 178.3 5.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -89.57 167.12 33.5 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -48.23 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.675 2.25 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.6 t -126.76 98.82 5.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.4 p -167.24 157.43 11.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 119.114 -0.826 . . . . 0.0 112.53 179.992 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 11.5 t -142.88 126.72 17.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.851 0.357 . . . . 0.0 110.881 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.0 t -84.73 62.89 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 91.47 -142.87 16.28 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.477 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 t 54.1 47.55 23.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 0.0 110.856 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.3 m -112.54 -65.38 1.19 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.865 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 175.92 150.2 7.92 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.504 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.0 t -114.43 72.0 0.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 111.145 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 96.44 -176.69 32.85 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.51 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.48 -31.61 70.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 110.888 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt 53.46 68.95 2.51 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.55 0.69 . . . . 0.0 110.866 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 127.54 14.75 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.699 2.266 . . . . 0.0 112.347 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 65.4 m-85 -76.55 137.97 39.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -120.63 119.77 33.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.928 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -61.37 120.7 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -85.04 3.62 37.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.882 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -89.98 -44.03 10.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.2 p -122.7 -35.89 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 24.37 5.54 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.48 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -90.92 127.0 36.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.897 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 39.0 t -92.47 147.48 5.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.075 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -131.7 170.92 14.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.863 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -81.85 -65.98 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 45.3 mtp85 -106.73 156.47 18.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.841 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -51.92 -42.17 62.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.8 t -52.41 -46.8 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -55.05 -31.12 60.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.81 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 11.5 tp -82.89 -31.92 27.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.14 -51.66 69.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -65.3 -28.72 69.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 77.5 t60 -69.53 -39.28 77.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -56.77 -24.64 51.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.919 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 53.6 mt -55.89 -26.04 45.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.4 tt -76.7 -25.94 16.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -92.23 -33.71 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.85 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 69.1 p -79.42 90.91 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -88.03 -133.5 4.27 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.537 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -79.37 151.98 30.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.933 0.397 . . . . 0.0 110.876 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 160.67 30.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.615 0.722 . . . . 0.0 110.871 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 102.09 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.729 2.286 . . . . 0.0 112.313 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.5 m -141.98 142.96 32.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.874 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -141.31 72.56 0.4 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.513 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -26.03 28.07 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.673 2.249 . . . . 0.0 112.373 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.11 105.91 0.37 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.842 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 12.9 t -113.9 -31.61 6.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.876 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.104 -0.831 . . . . 0.0 112.459 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 77.3 p -158.39 121.42 3.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 110.842 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 7.6 t -163.77 154.47 15.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.852 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 176.59 -165.48 35.78 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.475 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.1 m -132.1 118.73 20.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.844 0.354 . . . . 0.0 110.875 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 40.5 m -152.19 124.19 8.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 99.25 89.04 1.98 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.478 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 3.2 t -151.6 149.19 28.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 111.145 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 151.26 157.24 7.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.462 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -78.28 136.17 37.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.869 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -117.7 160.64 37.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.577 0.703 . . . . 0.0 110.903 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 119.79 6.68 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.707 2.272 . . . . 0.0 112.332 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -79.61 147.05 32.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 21.5 tttp -119.46 110.44 16.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.8 t -52.87 118.13 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -83.98 2.23 39.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.92 -42.42 11.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.56 -35.31 3.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.861 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.18 22.39 6.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.486 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -91.2 129.6 37.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 26.1 t -96.41 148.87 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.106 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -130.34 -177.36 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -82.88 -58.48 2.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.874 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -126.58 169.72 12.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.836 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -53.79 -45.8 70.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 60.6 m -52.36 -52.29 54.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -55.01 -27.89 47.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 9.7 tp -84.88 -31.11 23.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.9 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.094 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -55.78 -27.37 50.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 75.4 t60 -78.47 -36.4 45.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.839 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -55.7 -25.9 42.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 58.2 mt -54.78 -32.1 59.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.913 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 11.8 tt -68.13 -26.61 34.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.086 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -94.05 -62.43 1.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 14.2 t -112.81 147.16 37.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 179.47 -147.88 7.83 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -133.25 152.1 51.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.867 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -128.97 70.89 81.76 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.572 0.701 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 110.51 2.57 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 3.8 m 56.86 32.92 22.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -104.23 -168.12 24.88 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.517 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 140.26 42.2 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.71 2.274 . . . . 0.0 112.319 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 30.9 t -110.16 -42.7 4.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 9.3 p 53.51 33.98 17.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.874 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.493 179.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 42.6 m -105.94 136.45 45.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.86 0.362 . . . . 0.0 110.884 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.97 105.3 5.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -156.31 164.61 32.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.481 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.1 m -106.95 -64.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 110.842 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 61.3 m -108.18 101.87 11.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.863 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -146.63 -83.46 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.498 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 4.3 m -110.22 115.36 29.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.809 0.338 . . . . 0.0 111.179 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 106.6 143.19 11.15 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -83.72 161.08 21.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.39 . . . . 0.0 110.94 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -137.23 69.43 55.62 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.619 0.723 . . . . 0.0 110.925 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 125.78 12.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.643 2.228 . . . . 0.0 112.348 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 -78.22 146.86 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 50.3 tttt -125.54 122.04 35.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.4 t -62.92 119.01 8.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -83.82 2.07 40.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -90.06 -42.87 10.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 23.0 p -121.99 -34.9 3.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 109.52 23.49 6.26 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.523 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -90.73 127.14 36.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.96 149.82 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.127 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -135.38 162.2 33.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 44.9 ttm-85 -70.56 -56.71 5.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -116.47 179.79 3.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.82 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -81.8 -26.53 34.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 62.3 p -60.89 -38.79 86.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -69.58 -39.12 77.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.876 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 6.4 tp -72.15 -37.69 69.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.76 -45.97 63.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -77.58 -26.11 50.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.859 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 76.9 t60 -68.32 -26.9 65.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -67.59 -25.92 66.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.916 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.19 -43.31 70.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 10.9 tt -56.73 -24.63 19.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -89.91 -26.28 20.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 69.9 p -95.08 124.81 39.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -158.4 -67.5 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -133.72 139.84 46.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.885 0.374 . . . . 0.0 110.872 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -139.17 160.66 61.43 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.579 0.704 . . . . 0.0 110.897 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 96.47 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.67 2.247 . . . . 0.0 112.311 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 6.0 p -113.77 -57.21 2.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.859 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -93.76 -74.51 1.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.494 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 98.55 0.69 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.694 2.262 . . . . 0.0 112.365 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.4 t -94.82 -59.4 1.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.0 p 55.45 27.63 10.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 119.116 -0.824 . . . . 0.0 112.433 -179.933 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.1 p -138.72 138.87 38.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.887 0.375 . . . . 0.0 110.811 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 23.1 t -61.91 -41.99 98.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.844 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 81.71 -95.86 1.74 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.455 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 5.6 p -141.34 152.14 44.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 0.0 110.862 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 59.8 m -143.13 122.11 12.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -96.53 26.72 20.53 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.488 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 21.0 p -95.6 168.6 10.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.849 0.357 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 161.61 -115.92 0.68 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -166.34 139.78 4.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.873 0.368 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -127.99 160.67 60.24 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.596 0.712 . . . . 0.0 110.901 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 138.53 38.11 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.679 2.253 . . . . 0.0 112.352 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -77.59 143.53 38.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -122.01 120.13 33.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.2 119.06 8.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -83.28 -0.1 48.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -87.42 -42.88 12.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.5 p -122.58 -36.19 2.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.841 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.4 21.72 6.42 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.494 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.7 mttm -88.51 127.05 35.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 25.3 t -90.96 148.71 4.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -136.46 143.03 43.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -56.56 -64.24 0.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.882 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -103.47 -177.1 3.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.933 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -85.54 -32.46 22.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -54.67 -41.69 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.831 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -64.43 -39.03 93.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 12.2 tp -71.75 -39.0 70.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -53.41 -48.71 68.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.115 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -72.75 -26.37 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.87 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 79.5 t60 -68.45 -37.65 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -56.09 -26.0 47.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.6 mt -53.62 -43.91 69.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.897 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.1 tt -57.54 -24.41 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.174 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -96.62 -69.98 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 8.7 t -105.59 143.89 33.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.112 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -169.29 147.44 11.07 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.517 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -73.74 143.42 46.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 11.1 mptt 52.83 72.25 1.22 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.9 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 113.24 3.31 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.666 2.244 . . . . 0.0 112.354 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 7.2 t -82.37 122.75 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.861 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 148.44 71.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.508 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -43.46 2.66 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.681 2.254 . . . . 0.0 112.334 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.4 m -75.18 88.48 2.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 4.3 m -114.26 127.77 56.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.829 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 CA-C-O 119.154 -0.803 . . . . 0.0 112.509 -179.958 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.7 p -145.2 133.38 21.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 110.859 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 26.6 t -171.8 152.08 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 161.5 103.36 0.18 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.491 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.61 172.07 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.871 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 67.4 p -155.41 132.84 11.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.93 20.54 4.04 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.5 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 32.5 p -69.8 140.91 53.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.853 0.359 . . . . 0.0 111.147 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -140.48 90.05 0.19 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.459 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -115.22 31.04 6.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.875 0.369 . . . . 0.0 110.823 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.22 160.7 82.04 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.521 0.677 . . . . 0.0 110.908 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 111.13 2.73 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.243 . . . . 0.0 112.316 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 74.2 m-85 -74.7 137.37 42.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.916 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -117.28 128.21 54.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.866 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.68 119.25 13.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -82.98 1.23 40.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -88.75 -44.2 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.8 p -122.11 -35.03 3.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 21.67 6.62 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.47 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -88.05 124.32 33.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.7 t -92.14 149.56 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.115 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -130.19 -175.87 3.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 -28.46 6.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 56.9 mtt-85 -122.59 136.69 54.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -53.87 -34.97 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 65.7 m -64.97 -40.11 94.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.866 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 39.1 m170 -59.16 -32.4 69.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 12.8 tp -78.72 -35.06 45.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.33 -51.8 67.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.087 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -66.57 -28.21 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -70.04 -40.81 74.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -56.08 -25.31 44.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.34 -33.59 63.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 12.8 tt -67.0 -25.0 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -93.12 -53.56 4.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.875 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 20.7 p -72.57 124.17 24.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -141.12 93.8 0.19 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.471 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -129.51 60.29 1.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 0.0 110.861 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 56.75 73.66 0.78 Allowed Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.588 0.709 . . . . 0.0 110.868 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -179.21 2.76 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.647 2.231 . . . . 0.0 112.391 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 24.1 p -142.6 126.01 16.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -135.75 175.62 20.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.5 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 155.99 64.5 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.724 2.283 . . . . 0.0 112.306 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 91.8 p -116.35 177.93 4.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 15.4 t -93.07 125.24 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 CA-C-O 119.148 -0.807 . . . . 0.0 112.443 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 36.7 t -95.25 78.29 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.858 0.361 . . . . 0.0 110.89 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 44.8 t -123.63 154.8 38.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.854 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -147.53 -134.75 2.55 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.513 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.7 t -167.33 127.69 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.886 0.374 . . . . 0.0 110.834 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 22.2 m -114.61 86.32 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.864 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -135.2 73.14 0.45 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.518 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 38.8 m -88.78 85.69 6.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.797 0.332 . . . . 0.0 111.098 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 175.36 169.25 36.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.484 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -83.52 108.18 16.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.95 0.405 . . . . 0.0 110.896 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -84.71 160.71 55.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.569 0.7 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 121.16 7.85 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.658 2.239 . . . . 0.0 112.323 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -85.29 142.13 29.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.956 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 42.2 tttp -121.05 131.26 54.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.899 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 6.2 t -70.69 120.03 15.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.864 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -85.32 -0.3 54.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.91 -34.58 16.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 9.1 p -128.6 -39.36 1.65 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.65 22.29 5.79 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 15.9 mtmm -92.64 124.89 36.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.826 0.346 . . . . 0.0 110.885 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 42.1 t -94.39 146.73 6.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.119 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -124.48 -175.85 3.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.78 -49.82 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.849 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -119.34 148.22 43.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -52.0 -39.84 60.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.4 p -56.5 -39.31 73.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.815 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -68.0 -30.44 69.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 13.1 tp -80.67 -39.18 27.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.939 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.12 -48.16 76.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.137 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 37.0 mmm-85 -63.22 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 78.8 t60 -74.55 -39.12 62.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.898 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -55.85 -25.55 42.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.05 -31.95 61.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 13.1 tt -69.25 -25.62 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -92.02 -44.12 9.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 11.2 t -135.84 133.9 38.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.181 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -164.83 121.12 0.98 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.475 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -87.98 90.04 8.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.916 0.388 . . . . 0.0 110.882 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.9 tptt 57.55 73.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.593 0.711 . . . . 0.0 110.859 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 90.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.698 2.265 . . . . 0.0 112.333 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.8 p -65.72 -60.61 2.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.881 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -59.81 176.12 3.49 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.469 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 140.1 41.76 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.682 2.255 . . . . 0.0 112.364 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 4.1 m -128.66 -179.68 5.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.822 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 3.1 p -71.79 -36.58 70.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.436 179.988 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 16.7 t -123.25 -37.35 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.923 0.392 . . . . 0.0 110.876 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 2.1 m -96.27 147.82 23.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.884 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -152.82 82.13 0.17 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.462 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 63.2 m -66.18 -176.57 0.43 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.888 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 -63.94 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.47 135.04 2.99 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.471 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 16.2 p -92.86 124.34 36.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.757 0.313 . . . . 0.0 111.208 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -145.71 175.21 25.35 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.505 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.08 156.04 39.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.392 . . . . 0.0 110.883 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -123.85 70.25 48.48 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.533 0.683 . . . . 0.0 110.887 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 133.4 25.49 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 0.0 112.365 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -77.23 143.34 39.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.919 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -123.74 111.2 15.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.8 t -51.98 120.19 5.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -85.77 4.44 36.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -90.08 -45.33 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 21.2 p -121.88 -34.73 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.19 23.97 5.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.507 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -90.21 129.43 36.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -95.71 149.91 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -137.41 157.77 45.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.867 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -63.7 -72.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -101.8 178.28 4.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -75.57 -35.13 60.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.0 p -52.23 -50.72 61.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -58.15 -38.87 77.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.3 tp -70.71 -28.95 65.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.876 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.75 11.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.087 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -59.54 -26.3 65.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -83.33 -18.71 38.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.32 -17.54 51.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 10.6 mt -95.7 26.27 4.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 10.1 tt -114.04 -26.63 2.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -87.47 -38.68 15.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.84 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 2.2 t -108.55 151.0 26.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.143 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 153.93 -88.07 0.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.482 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -98.22 67.67 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.892 0.377 . . . . 0.0 110.866 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -163.64 73.45 1.83 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.565 0.697 . . . . 0.0 110.867 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 121.85 8.53 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 10.6 p -57.39 156.59 7.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -141.69 172.0 24.17 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.48 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 108.9 2.19 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.653 2.235 . . . . 0.0 112.355 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 59.0 p -106.93 -37.78 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.889 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 1.8 t -125.53 144.9 50.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.847 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 CA-C-O 119.136 -0.813 . . . . 0.0 112.512 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 19.0 m -121.57 179.01 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.843 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 14.2 t -129.07 133.82 47.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -57.91 107.49 1.08 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.474 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.5 p -70.8 -53.65 14.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.829 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.7 p -96.25 153.97 17.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -137.81 -110.33 0.96 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.448 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 8.0 t -145.86 142.38 28.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.834 0.349 . . . . 0.0 111.12 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -154.3 -161.6 10.57 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.476 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -103.16 -38.38 7.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.925 0.393 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -152.33 68.32 7.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.622 0.725 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 122.94 9.63 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 27.2 m-85 -78.2 147.94 34.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.947 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -128.98 112.09 13.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.913 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.2 t -57.4 120.61 8.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -81.8 -12.81 58.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -69.39 -45.27 69.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.874 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 6.9 p -119.3 -42.0 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.23 23.93 4.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.481 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -91.77 137.41 32.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.798 0.332 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.24 150.11 5.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -135.0 161.99 33.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -62.01 -73.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -113.44 -176.25 2.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.838 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -70.0 -36.94 75.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 -37.99 68.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -68.29 -45.46 72.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.841 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.8 tp -67.41 -32.46 73.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.0 -53.9 36.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.112 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 22.4 mmt-85 -64.22 -26.26 68.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -77.37 -23.94 50.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.841 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -72.91 -10.32 59.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.23 25.16 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.889 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.3 tt -112.79 -26.71 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -85.55 -37.51 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 70.7 p -58.04 -37.34 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 107.19 173.65 22.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.495 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -110.54 -70.07 0.83 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -133.41 160.27 69.28 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.552 0.691 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -13.85 35.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.7 2.267 . . . . 0.0 112.348 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 21.2 m -76.13 143.9 40.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.843 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 146.28 172.65 16.8 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.504 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 83.76 0.68 Allowed 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.68 2.253 . . . . 0.0 112.329 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.1 m -78.65 84.14 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.833 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 15.8 m -152.73 161.35 42.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.854 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 CA-C-O 119.166 -0.797 . . . . 0.0 112.528 -179.959 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.4 p -86.34 93.5 9.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.834 0.35 . . . . 0.0 110.895 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 22.3 t -148.49 147.48 29.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.868 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 96.03 127.78 5.47 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.46 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 43.4 t -144.92 153.27 41.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.849 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 5.0 m -135.27 171.55 14.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.88 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 146.98 78.57 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.48 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 29.2 m -156.02 130.08 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.837 0.351 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -154.22 77.21 0.21 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.485 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -98.85 28.44 4.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.947 0.403 . . . . 0.0 110.893 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -65.64 160.65 59.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.571 0.7 . . . . 0.0 110.929 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 129.08 17.01 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.364 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -76.16 138.48 40.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.936 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -119.27 129.89 55.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.31 119.29 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.917 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -79.46 -7.63 58.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.849 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.4 -49.09 17.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.937 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.1 p -117.2 -40.35 3.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.79 21.41 4.63 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.46 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -88.46 128.09 35.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.815 0.34 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.81 146.85 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.129 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -127.02 -176.42 3.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -94.03 -67.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -105.58 150.99 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -52.0 -30.05 23.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.9 t -58.28 -49.89 75.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.859 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -57.41 -44.09 84.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 9.0 tp -67.36 -32.39 73.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.898 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.04 -54.63 27.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.064 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.57 -26.05 68.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -79.43 -18.73 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.847 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -79.49 -16.77 55.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 12.7 mt -95.67 25.96 4.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 9.8 tt -112.89 -26.67 2.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -89.37 -37.84 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 57.5 p -52.49 119.86 4.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.184 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 161.02 -89.15 0.11 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.515 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 57.69 46.08 17.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 0.0 110.845 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -161.68 71.49 2.46 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.54 0.686 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 119.62 6.54 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.657 2.238 . . . . 0.0 112.357 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 15.4 m -59.28 127.24 31.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.833 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -148.81 -176.2 21.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.461 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 101.6 0.93 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.722 2.281 . . . . 0.0 112.346 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 49.5 m -54.76 152.97 6.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 13.7 t -162.18 111.32 1.46 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.871 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-O 119.154 -0.803 . . . . 0.0 112.506 -179.992 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.449 -0.26 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 11.1 p -111.26 66.74 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.382 . . . . 0.0 110.841 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 7.8 t -57.77 144.32 38.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 93.2 37.88 5.53 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.456 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 11.7 t -85.74 96.84 9.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.888 0.375 . . . . 0.0 110.819 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 52.8 m -54.9 158.09 2.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.869 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -101.57 105.6 2.89 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 14.8 t -95.83 167.88 10.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.872 0.368 . . . . 0.0 111.13 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -87.73 81.39 1.62 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.495 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -80.22 118.67 22.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 110.905 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? 52.14 68.38 3.21 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.526 0.679 . . . . 0.0 110.877 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 126.03 12.81 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.678 2.252 . . . . 0.0 112.31 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 77.2 m-85 -66.28 141.87 57.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.905 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -127.79 109.73 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.897 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.6 t -53.17 119.37 4.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -81.1 -16.39 53.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.837 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.68 -47.19 82.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 7.5 p -118.07 -41.74 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.88 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.61 27.04 2.92 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.2 mttm -95.75 132.27 41.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.823 0.344 . . . . 0.0 110.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 46.5 t -94.57 147.05 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.147 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -129.66 139.39 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.849 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -52.09 -44.68 64.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.877 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -135.59 170.03 16.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.867 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -67.58 -36.81 81.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.926 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 4.9 p -52.11 -34.95 46.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.865 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -77.63 -34.86 53.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 7.5 tp -73.03 -28.68 62.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.37 -56.96 15.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.108 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -60.52 -26.05 66.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' HIS . . . . . . . . . . . . . 70.7 t60 -79.73 -24.02 41.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -71.8 -9.75 58.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 14.1 mt -98.82 24.64 7.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . . . . . . . . . 14.6 tt -112.57 -26.62 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.17 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -86.65 -36.27 18.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 3.2 t -109.09 -26.74 9.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 53.78 80.46 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.25 -39.34 40.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.383 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -106.56 159.26 30.47 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.571 0.7 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 80.23 0.89 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.659 2.239 . . . . 0.0 112.355 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 3.4 t -168.68 153.93 6.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 148.26 178.02 23.06 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.483 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 -35.43 12.9 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.649 2.233 . . . . 0.0 112.379 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.9 p -112.0 114.96 28.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 6.0 t -79.46 -43.43 23.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.873 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 CA-C-O 119.102 -0.832 . . . . 0.0 112.503 -179.977 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.765 0.235 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.431 ' HB3' HD22 ' A' ' 472' ' ' LEU . 49.3 m-85 -76.01 146.46 39.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -126.71 119.57 27.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.907 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 14.1 t -62.83 118.92 8.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.923 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 -80.02 -12.19 59.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -69.14 -49.26 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.3 p -117.13 -40.4 3.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 117.12 21.76 4.4 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.455 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -89.78 130.98 35.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 0.0 110.918 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.58 149.91 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.114 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -135.09 150.34 50.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -62.14 -65.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -101.89 -179.83 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.907 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -78.71 -42.16 29.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.6 m -52.09 -43.64 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -57.42 -35.82 70.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.8 tp -76.65 -33.99 58.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.55 -55.17 37.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.105 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -32.47 72.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.1 t60 -67.76 -38.73 83.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -55.18 -26.48 39.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.883 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.4 mt -54.2 -36.4 63.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.204 0 CA-C-O 120.757 0.232 . . . . 0.0 112.358 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -70.15 139.36 52.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 59.2 tttt -118.4 109.15 15.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -51.95 120.78 5.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.872 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -86.01 4.72 36.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -90.05 -43.75 10.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 p -122.8 -35.55 3.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.853 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.93 24.36 5.22 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.505 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -91.99 127.29 37.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.814 0.34 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.9 t -92.07 149.76 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -139.62 156.99 46.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.41 -74.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.878 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 44.1 mtt85 -106.67 155.18 19.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -51.93 -33.35 36.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -53.33 -35.75 60.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.841 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -73.02 -32.07 64.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.8 tp -78.07 -33.09 51.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.76 -53.56 53.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -27.31 66.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 73.7 t60 -66.47 -41.92 88.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -56.82 -24.48 51.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 79.5 mt -55.94 -26.64 48.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.2 tt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.149 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.173 0 CA-C-O 120.851 0.271 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.421 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.0 m-85 -84.52 119.5 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.427 ' HG3' HG22 ' A' ' 465' ' ' VAL . 18.2 tttp -100.41 113.53 26.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.881 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -57.37 121.13 9.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -85.5 4.03 37.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.82 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -90.06 -44.68 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.909 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.43 -35.12 3.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.45 22.63 5.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.483 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -90.92 126.07 35.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.427 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.3 t -91.5 147.87 4.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.182 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -137.09 135.07 37.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -53.2 -62.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -96.53 170.81 8.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -79.08 -30.39 43.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.12 -43.36 87.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.839 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -59.02 -27.08 65.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.877 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -83.53 -36.71 23.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.52 -52.77 60.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -70.73 -26.63 63.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.8 t60 -68.66 -39.79 80.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.853 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -55.75 -25.86 42.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.9 mt -54.52 -35.02 62.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.9 tt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.161 0 CA-C-O 120.809 0.254 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.605 ' HB3' HD22 ' A' ' 472' ' ' LEU . 34.7 m-85 -86.33 144.72 27.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 13.3 tttm -121.87 126.15 48.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -69.94 120.95 16.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -84.09 1.85 42.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.817 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -89.38 -43.42 10.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.5 p -122.64 -35.8 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.72 23.18 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.511 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttm -89.14 127.83 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.815 0.34 . . . . 0.0 110.936 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 29.1 t -93.86 146.16 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -131.76 156.18 46.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -72.49 -60.9 2.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.829 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.1 mmt-85 -96.92 -177.54 3.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -88.02 -38.46 15.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.5 p -55.79 -44.16 77.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -55.48 -37.73 68.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 457' ' ' TYR . 16.9 tp -74.82 -38.33 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.896 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.17 -53.69 49.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.09 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.427 ' HD3' HD11 ' A' ' 477' ' ' LEU . 20.2 mmt180 -65.19 -28.04 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.646 ' O ' HG22 ' A' ' 478' ' ' ILE . 80.4 t60 -69.64 -41.23 75.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.826 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -55.79 -25.92 43.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.427 HD11 ' HD3' ' A' ' 474' ' ' ARG . 64.7 mt -54.58 -33.63 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.6 tt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.179 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.809 0.254 . . . . 0.0 112.371 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.585 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.5 m-85 -82.23 138.89 34.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.926 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -117.79 130.28 56.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.0 t -74.69 121.14 21.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -82.7 0.78 41.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -88.84 -41.67 12.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.871 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 12.1 p -125.09 -38.22 2.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.832 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.54 23.09 5.81 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.459 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -89.85 113.89 25.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.891 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.6 t -85.33 144.83 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.099 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -125.77 171.88 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.863 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -84.42 -52.7 5.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -110.01 177.45 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.835 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -80.0 -42.75 23.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.8 t -52.1 -43.35 63.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -57.37 -37.16 72.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.0 tp -77.41 -35.42 54.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.991 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.87 -52.62 56.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -68.69 -26.15 65.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.9 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.658 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.8 t60 -69.79 -39.07 76.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.798 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -54.92 -26.67 37.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.944 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.33 -40.7 68.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.911 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.658 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.152 0 CA-C-O 120.763 0.234 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.587 ' HB3' HD22 ' A' ' 472' ' ' LEU . 39.3 m-85 -79.31 141.97 36.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 465' ' ' VAL . 69.4 tttt -124.47 108.93 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 3.7 t -51.99 118.19 3.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.874 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.0 t-160 -84.26 0.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.852 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.05 -40.4 12.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.7 p -122.93 -35.61 3.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 108.81 25.19 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.526 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -92.07 126.69 37.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.442 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.7 t -91.47 148.68 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.085 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -135.21 162.56 32.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -78.77 -63.61 1.37 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 40.4 mmm-85 -99.33 167.13 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -69.74 -34.06 73.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.1 m -61.07 -46.94 88.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -52.36 -32.11 36.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.587 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -82.07 -34.9 29.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.961 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.79 -53.96 51.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -62.78 -27.26 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.82 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.637 ' O ' HG22 ' A' ' 478' ' ' ILE . 69.8 t60 -72.61 -38.05 67.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -56.25 -25.31 47.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 55.2 mt -55.32 -28.94 57.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.637 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.9 tt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.77 0.237 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -75.79 141.93 42.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 56.0 tttt -120.8 109.84 15.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.897 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.3 t -51.97 118.45 3.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -84.15 2.41 39.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -89.96 -41.12 11.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.6 p -123.99 -36.41 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.62 5.54 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -90.87 129.18 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 0.0 110.854 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.12 149.99 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.113 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -141.36 148.78 40.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -55.07 -72.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.858 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -100.85 -175.14 2.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -86.36 -32.83 20.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.851 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.38 -33.87 55.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -74.09 -37.53 64.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.874 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 tp -73.1 -35.34 66.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.78 -49.69 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.093 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -74.2 -25.85 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.694 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.7 t60 -70.95 -22.29 62.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -74.26 -20.5 60.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 43.5 mt -66.29 -38.97 89.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.7 tt . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.14 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--O 1.231 0.165 0 CA-C-O 120.754 0.231 . . . . 0.0 112.311 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.419 ' HB3' HD22 ' A' ' 472' ' ' LEU . 43.1 m-85 -70.51 136.33 49.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.941 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 19.4 tttp -115.53 111.28 20.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.863 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -54.02 120.88 6.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -85.73 4.3 37.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.869 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -89.99 -46.44 8.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.899 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.88 -34.17 3.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.78 23.61 5.55 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.483 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -90.48 126.9 36.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.829 0.347 . . . . 0.0 110.873 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.8 t -92.3 149.34 4.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.138 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -140.97 139.98 34.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.5 ttt-85 -52.37 -66.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -103.01 169.39 8.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -72.77 -32.72 65.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 88.7 p -52.09 -37.96 55.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -70.1 -34.75 73.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.3 tp -75.98 -31.23 58.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.946 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -58.12 -56.67 19.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.58 -26.78 67.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.654 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.3 t60 -67.22 -40.15 86.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -55.91 -25.66 43.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.924 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 68.9 mt -54.76 -33.42 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.7 tt . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 N--CA 1.466 -0.13 0 CA-C-O 120.802 0.251 . . . . 0.0 112.345 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -71.37 145.92 49.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.863 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 465' ' ' VAL . 74.9 tttt -126.46 122.55 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -62.66 120.8 11.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -85.38 3.97 37.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.04 -45.78 8.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.942 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.3 p -120.52 -33.26 3.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.26 5.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -94.41 126.33 39.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.811 0.338 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.434 HG22 ' HG3' ' A' ' 458' ' ' LYS . 43.2 t -93.2 147.33 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.151 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -132.89 173.17 11.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -75.64 -73.26 0.27 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.846 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.53 160.59 15.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -52.0 -36.48 50.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.0 m -54.3 -49.95 68.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -56.24 -29.75 61.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.4 tp -81.88 -36.48 28.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.909 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.87 -51.87 64.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -65.4 -27.23 68.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.64 ' O ' HG22 ' A' ' 478' ' ' ILE . 81.1 t60 -72.35 -40.14 67.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -56.01 -25.42 44.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.0 mt -55.33 -28.84 56.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.0 tt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.755 0.231 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.435 ' HB3' HD22 ' A' ' 472' ' ' LEU . 51.6 m-85 -77.83 142.01 38.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.924 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -121.4 126.38 49.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 17.9 t -66.67 115.2 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.911 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -77.62 -5.93 52.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.0 -54.77 5.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.7 p -111.2 -36.7 5.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.34 27.22 3.99 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -95.45 127.0 41.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.6 150.02 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.109 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -134.48 -177.18 4.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -90.17 -73.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.58 164.34 12.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -65.12 -31.0 71.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 20.9 t -61.56 -46.03 91.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -55.89 -34.25 65.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.435 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -80.36 -40.3 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.956 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.77 -38.57 56.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.98 -25.95 36.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.702 ' O ' HG22 ' A' ' 478' ' ' ILE . 74.1 t60 -70.56 -28.89 65.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.839 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.73 -24.83 67.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.866 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.41 -44.02 75.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.939 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.702 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.14 0 CA-C-O 120.779 0.241 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.467 ' HB3' HD22 ' A' ' 472' ' ' LEU . 65.4 m-85 -76.55 137.97 39.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -120.63 119.77 33.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.928 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -61.37 120.7 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -85.04 3.62 37.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.882 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -89.98 -44.03 10.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.2 p -122.7 -35.89 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 24.37 5.54 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.48 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -90.92 127.0 36.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.897 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 39.0 t -92.47 147.48 5.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.075 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -131.7 170.92 14.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.863 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -81.85 -65.98 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 45.3 mtp85 -106.73 156.47 18.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.841 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -51.92 -42.17 62.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.8 t -52.41 -46.8 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -55.05 -31.12 60.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.81 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.5 tp -82.89 -31.92 27.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.14 -51.66 69.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -65.3 -28.72 69.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.648 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.5 t60 -69.53 -39.28 77.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -56.77 -24.64 51.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.919 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 53.6 mt -55.89 -26.04 45.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.648 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.4 tt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.796 0.248 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.56 ' HB3' HD22 ' A' ' 472' ' ' LEU . 17.5 m-85 -79.61 147.05 32.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.451 ' HG3' HG22 ' A' ' 465' ' ' VAL . 21.5 tttp -119.46 110.44 16.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.8 t -52.87 118.13 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -83.98 2.23 39.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.92 -42.42 11.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.56 -35.31 3.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.861 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.18 22.39 6.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.486 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -91.2 129.6 37.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.451 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.1 t -96.41 148.87 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.106 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -130.34 -177.36 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -82.88 -58.48 2.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.874 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -126.58 169.72 12.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.836 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -53.79 -45.8 70.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 60.6 m -52.36 -52.29 54.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -55.01 -27.89 47.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -84.88 -31.11 23.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.9 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.094 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -55.78 -27.37 50.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.633 ' O ' HG22 ' A' ' 478' ' ' ILE . 75.4 t60 -78.47 -36.4 45.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -55.7 -25.9 42.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 58.2 mt -54.78 -32.1 59.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.913 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.086 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.796 0.249 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.437 ' HB3' HD22 ' A' ' 472' ' ' LEU . 24.1 m-85 -78.22 146.86 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 50.3 tttt -125.54 122.04 35.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.4 t -62.92 119.01 8.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -83.82 2.07 40.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -90.06 -42.87 10.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 23.0 p -121.99 -34.9 3.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 109.52 23.49 6.26 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.523 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -90.73 127.14 36.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.96 149.82 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.127 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -135.38 162.2 33.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 44.9 ttm-85 -70.56 -56.71 5.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -116.47 179.79 3.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.82 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -81.8 -26.53 34.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 62.3 p -60.89 -38.79 86.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -69.58 -39.12 77.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.876 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.437 HD22 ' HB3' ' A' ' 457' ' ' TYR . 6.4 tp -72.15 -37.69 69.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.76 -45.97 63.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -77.58 -26.11 50.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.859 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.664 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.9 t60 -68.32 -26.9 65.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -67.59 -25.92 66.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.916 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.19 -43.31 70.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.9 tt . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.231 0.149 0 CA-C-O 120.798 0.249 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.54 ' HB3' HD22 ' A' ' 472' ' ' LEU . 28.9 m-85 -77.59 143.53 38.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -122.01 120.13 33.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.2 119.06 8.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -83.28 -0.1 48.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -87.42 -42.88 12.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.5 p -122.58 -36.19 2.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.841 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.4 21.72 6.42 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.494 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.7 mttm -88.51 127.05 35.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 25.3 t -90.96 148.71 4.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -136.46 143.03 43.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -56.56 -64.24 0.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.882 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -103.47 -177.1 3.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.933 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -85.54 -32.46 22.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -54.67 -41.69 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.831 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -64.43 -39.03 93.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.54 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.2 tp -71.75 -39.0 70.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -53.41 -48.71 68.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.115 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -72.75 -26.37 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.87 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.5 t60 -68.45 -37.65 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -56.09 -26.0 47.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.6 mt -53.62 -43.91 69.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.897 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.1 tt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.174 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.755 0.231 . . . . 0.0 112.316 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.509 ' HB3' HD22 ' A' ' 472' ' ' LEU . 74.2 m-85 -74.7 137.37 42.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.916 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -117.28 128.21 54.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.866 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.68 119.25 13.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -82.98 1.23 40.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -88.75 -44.2 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.8 p -122.11 -35.03 3.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 21.67 6.62 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.47 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -88.05 124.32 33.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.7 t -92.14 149.56 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.115 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -130.19 -175.87 3.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 -28.46 6.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 56.9 mtt-85 -122.59 136.69 54.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -53.87 -34.97 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 65.7 m -64.97 -40.11 94.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.866 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 39.1 m170 -59.16 -32.4 69.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.509 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.8 tp -78.72 -35.06 45.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.33 -51.8 67.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.087 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -66.57 -28.21 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.65 ' O ' HG22 ' A' ' 478' ' ' ILE . 67.9 t60 -70.04 -40.81 74.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -56.08 -25.31 44.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.34 -33.59 63.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.761 0.234 . . . . 0.0 112.323 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.733 ' HB3' HD22 ' A' ' 472' ' ' LEU . 44.0 m-85 -85.29 142.13 29.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.956 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.406 ' HG3' HG22 ' A' ' 465' ' ' VAL . 42.2 tttp -121.05 131.26 54.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.899 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 6.2 t -70.69 120.03 15.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.864 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -85.32 -0.3 54.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.91 -34.58 16.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 9.1 p -128.6 -39.36 1.65 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.65 22.29 5.79 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 15.9 mtmm -92.64 124.89 36.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.826 0.346 . . . . 0.0 110.885 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.406 HG22 ' HG3' ' A' ' 458' ' ' LYS . 42.1 t -94.39 146.73 6.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.119 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -124.48 -175.85 3.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.78 -49.82 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.849 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -119.34 148.22 43.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -52.0 -39.84 60.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.4 p -56.5 -39.31 73.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.815 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -68.0 -30.44 69.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.1 tp -80.67 -39.18 27.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.939 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.12 -48.16 76.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.137 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 37.0 mmm-85 -63.22 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.652 ' O ' HG22 ' A' ' 478' ' ' ILE . 78.8 t60 -74.55 -39.12 62.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.898 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -55.85 -25.55 42.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.05 -31.95 61.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.652 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.1 tt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.134 0 CA-C-O 120.796 0.248 . . . . 0.0 112.365 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.591 ' HB3' HD22 ' A' ' 472' ' ' LEU . 33.6 m-85 -77.23 143.34 39.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.919 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.496 ' HG3' HG22 ' A' ' 465' ' ' VAL . 40.7 tttt -123.74 111.2 15.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.8 t -51.98 120.19 5.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -85.77 4.44 36.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -90.08 -45.33 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 21.2 p -121.88 -34.73 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.19 23.97 5.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.507 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -90.21 129.43 36.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.496 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.8 t -95.71 149.91 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -137.41 157.77 45.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.867 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -63.7 -72.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -101.8 178.28 4.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -75.57 -35.13 60.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.0 p -52.23 -50.72 61.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -58.15 -38.87 77.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.591 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.3 tp -70.71 -28.95 65.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.876 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.75 11.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.087 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -59.54 -26.3 65.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.624 ' O ' HG22 ' A' ' 478' ' ' ILE . 85.6 t60 -83.33 -18.71 38.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.32 -17.54 51.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 10.6 mt -95.7 26.27 4.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.1 tt . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.171 0 CA-C-O 120.77 0.237 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.481 ' HB3' HD22 ' A' ' 472' ' ' LEU . 27.2 m-85 -78.2 147.94 34.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.947 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -128.98 112.09 13.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.913 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.2 t -57.4 120.61 8.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -81.8 -12.81 58.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -69.39 -45.27 69.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.874 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 6.9 p -119.3 -42.0 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.23 23.93 4.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.481 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -91.77 137.41 32.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.798 0.332 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.24 150.11 5.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -135.0 161.99 33.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -62.01 -73.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -113.44 -176.25 2.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.838 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -70.0 -36.94 75.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 -37.99 68.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -68.29 -45.46 72.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.841 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.481 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.8 tp -67.41 -32.46 73.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.0 -53.9 36.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.112 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 22.4 mmt-85 -64.22 -26.26 68.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.583 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.9 t60 -77.37 -23.94 50.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.841 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -72.91 -10.32 59.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.23 25.16 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.889 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.3 tt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.252 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.723 ' HB3' HD22 ' A' ' 472' ' ' LEU . 42.4 m-85 -76.16 138.48 40.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.936 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -119.27 129.89 55.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.31 119.29 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.917 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -79.46 -7.63 58.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.849 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.4 -49.09 17.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.937 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.1 p -117.2 -40.35 3.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.79 21.41 4.63 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.46 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -88.46 128.09 35.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.815 0.34 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.81 146.85 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.129 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -127.02 -176.42 3.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -94.03 -67.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -105.58 150.99 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -52.0 -30.05 23.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.9 t -58.28 -49.89 75.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.859 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -57.41 -44.09 84.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.723 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.0 tp -67.36 -32.39 73.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.898 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.04 -54.63 27.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.064 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.57 -26.05 68.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.614 ' O ' HG22 ' A' ' 478' ' ' ILE . 83.0 t60 -79.43 -18.73 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.847 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -79.49 -16.77 55.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 12.7 mt -95.67 25.96 4.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.614 HG22 ' O ' ' A' ' 475' ' ' HIS . 9.8 tt . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.811 0.254 . . . . 0.0 112.31 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 457' ' ' TYR . . . . . 0.47 ' HB3' HD22 ' A' ' 472' ' ' LEU . 77.2 m-85 -66.28 141.87 57.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.905 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 458' ' ' LYS . . . . . 0.466 ' HG3' HG22 ' A' ' 465' ' ' VAL . 77.2 tttt -127.79 109.73 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.897 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.6 t -53.17 119.37 4.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -81.1 -16.39 53.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.837 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.68 -47.19 82.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 7.5 p -118.07 -41.74 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.88 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.61 27.04 2.92 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.2 mttm -95.75 132.27 41.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.823 0.344 . . . . 0.0 110.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 ' HG3' ' A' ' 458' ' ' LYS . 46.5 t -94.57 147.05 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -129.66 139.39 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.849 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -52.09 -44.68 64.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.877 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -135.59 170.03 16.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.867 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -67.58 -36.81 81.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.926 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 4.9 p -52.11 -34.95 46.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.865 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -77.63 -34.86 53.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 472' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.5 tp -73.03 -28.68 62.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.37 -56.96 15.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.108 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -60.52 -26.05 66.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' HIS . . . . . 0.594 ' O ' HG22 ' A' ' 478' ' ' ILE . 70.7 t60 -79.73 -24.02 41.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -71.8 -9.75 58.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 14.1 mt -98.82 24.64 7.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.17 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 60.5 m -60.49 140.68 57.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 94.0 p -115.04 165.81 12.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.892 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 111.18 108.64 3.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.511 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 4.2 p -113.04 150.15 32.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.842 0.353 . . . . 0.0 110.853 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.9 p -96.58 54.31 1.34 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.853 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 76.1 -132.47 12.86 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 9.9 t -65.1 -25.82 67.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.149 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 60.06 -156.96 28.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.502 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -168.96 159.28 9.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.875 0.369 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.25 73.78 10.91 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.559 0.695 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 129.39 17.55 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.74 2.293 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.431 ' HB3' HD22 ' A' ' 472' ' ' LEU . 49.3 m-85 -76.01 146.46 39.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -126.71 119.57 27.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.907 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 14.1 t -62.83 118.92 8.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.923 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 -80.02 -12.19 59.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -69.14 -49.26 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.3 p -117.13 -40.4 3.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 117.12 21.76 4.4 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.455 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -89.78 130.98 35.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 0.0 110.918 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.58 149.91 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.114 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -135.09 150.34 50.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -62.14 -65.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -101.89 -179.83 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.907 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -78.71 -42.16 29.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.6 m -52.09 -43.64 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -57.42 -35.82 70.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.8 tp -76.65 -33.99 58.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.55 -55.17 37.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.105 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -32.47 72.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.1 t60 -67.76 -38.73 83.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -55.18 -26.48 39.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.883 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.4 mt -54.2 -36.4 63.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt -63.42 -25.67 38.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -96.83 -67.16 0.86 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 3.6 t -104.25 152.69 21.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.126 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -140.91 82.09 0.24 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -115.83 99.94 7.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.886 0.374 . . . . 0.0 110.895 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -116.46 71.82 4.95 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.589 0.709 . . . . 0.0 110.902 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -46.59 1.17 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.714 2.276 . . . . 0.0 112.323 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 2.0 t -69.3 105.39 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.842 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 134.41 75.19 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.523 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 151.89 68.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -105.27 -59.39 1.76 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.858 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 10.0 p -62.24 -50.39 71.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 119.126 -0.819 . . . . 0.0 112.461 -179.977 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 8.7 t -114.44 61.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.869 0.366 . . . . 0.0 110.887 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.2 m -103.0 160.84 14.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.86 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -53.07 -38.18 55.43 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.7 t -147.64 157.83 43.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.835 0.35 . . . . 0.0 110.889 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 27.7 t -115.31 -56.71 2.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.842 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 147.99 -104.09 0.28 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.489 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 5.6 p -87.03 -52.54 5.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 111.125 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 83.33 62.46 1.8 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.463 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -119.86 76.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -127.85 71.4 78.29 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.563 0.697 . . . . 0.0 110.917 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 111.35 2.78 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.663 2.242 . . . . 0.0 112.358 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -70.15 139.36 52.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 59.2 tttt -118.4 109.15 15.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -51.95 120.78 5.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.872 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -86.01 4.72 36.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -90.05 -43.75 10.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 p -122.8 -35.55 3.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.853 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.93 24.36 5.22 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.505 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -91.99 127.29 37.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.814 0.34 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.9 t -92.07 149.76 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -139.62 156.99 46.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.41 -74.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.878 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 44.1 mtt85 -106.67 155.18 19.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -51.93 -33.35 36.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -53.33 -35.75 60.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.841 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -73.02 -32.07 64.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.8 tp -78.07 -33.09 51.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.76 -53.56 53.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -27.31 66.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 73.7 t60 -66.47 -41.92 88.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -56.82 -24.48 51.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 79.5 mt -55.94 -26.64 48.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.2 tt -76.6 -25.55 16.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.149 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -90.03 -31.39 17.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 7.8 t -159.37 145.53 16.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.13 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -130.62 125.26 4.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.554 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -103.13 49.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 0.0 110.888 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -167.62 71.65 0.94 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.577 0.704 . . . . 0.0 110.924 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 179.31 3.78 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.387 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 21.4 p -84.6 -177.8 6.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.889 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -137.6 167.59 24.74 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.523 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -43.48 2.58 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.274 . . . . 0.0 112.308 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 6.2 t -115.62 138.55 50.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 7.4 p 53.37 28.84 7.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.886 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.099 -0.834 . . . . 0.0 112.495 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.435 -0.266 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.6 m -103.69 136.64 43.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.903 0.382 . . . . 0.0 110.835 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 54.6 p -71.27 -34.49 70.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.849 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -94.71 150.23 19.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.468 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 87.4 p -141.53 156.5 45.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.879 0.371 . . . . 0.0 110.816 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 27.7 p -98.56 98.76 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.904 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.13 129.41 5.41 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.479 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.64 107.69 19.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.13 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -171.35 -115.37 0.35 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.499 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -114.05 109.18 18.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 110.858 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.04 73.63 0.54 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.572 0.701 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 161.2 46.83 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.695 2.263 . . . . 0.0 112.312 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.421 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.0 m-85 -84.52 119.5 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.427 ' HG3' HG22 ' A' ' 465' ' ' VAL . 18.2 tttp -100.41 113.53 26.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.881 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -57.37 121.13 9.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -85.5 4.03 37.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.82 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -90.06 -44.68 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.909 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.43 -35.12 3.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.45 22.63 5.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.483 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -90.92 126.07 35.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.427 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.3 t -91.5 147.87 4.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.182 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -137.09 135.07 37.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -53.2 -62.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -96.53 170.81 8.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -79.08 -30.39 43.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.12 -43.36 87.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.839 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -59.02 -27.08 65.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.877 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -83.53 -36.71 23.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.52 -52.77 60.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -70.73 -26.63 63.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.8 t60 -68.66 -39.79 80.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.853 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -55.75 -25.86 42.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.9 mt -54.52 -35.02 62.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.9 tt -65.63 -25.4 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -95.63 -63.46 1.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 40.7 p -52.49 114.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -73.76 109.21 2.73 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.454 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -160.17 154.23 23.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.9 0.381 . . . . 0.0 110.889 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -117.81 72.85 8.55 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.568 0.699 . . . . 0.0 110.892 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 82.94 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.71 2.273 . . . . 0.0 112.333 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.9 t -80.26 147.78 31.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.86 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -96.26 -174.46 35.87 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.539 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -34.29 14.75 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.609 2.206 . . . . 0.0 112.357 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 5.0 p -112.25 36.04 3.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.856 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.3 t 59.21 44.53 15.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.901 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.494 -179.982 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.464 -0.254 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 8.0 m -149.96 166.96 28.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.386 . . . . 0.0 110.836 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 12.9 p -163.45 146.69 10.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.888 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -101.41 65.74 0.48 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.493 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 34.7 m -85.18 -30.92 23.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.924 0.393 . . . . 0.0 110.893 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 29.4 t -74.53 137.04 42.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.94 56.37 1.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.466 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 71.7 p -58.95 147.41 34.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.125 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 145.46 -57.38 0.52 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.48 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -110.1 100.32 9.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -159.05 68.4 3.29 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.68 28.56 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.704 2.269 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.605 ' HB3' HD22 ' A' ' 472' ' ' LEU . 34.7 m-85 -86.33 144.72 27.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 13.3 tttm -121.87 126.15 48.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -69.94 120.95 16.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -84.09 1.85 42.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.817 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -89.38 -43.42 10.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.5 p -122.64 -35.8 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.72 23.18 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.511 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttm -89.14 127.83 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.815 0.34 . . . . 0.0 110.936 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 29.1 t -93.86 146.16 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -131.76 156.18 46.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -72.49 -60.9 2.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.829 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.1 mmt-85 -96.92 -177.54 3.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -88.02 -38.46 15.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.5 p -55.79 -44.16 77.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -55.48 -37.73 68.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 457' ' ' TYR . 16.9 tp -74.82 -38.33 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.896 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.17 -53.69 49.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.09 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.427 ' HD3' HD11 ' A' ' 477' ' ' LEU . 20.2 mmt180 -65.19 -28.04 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.646 ' O ' HG22 ' A' ' 478' ' ' ILE . 80.4 t60 -69.64 -41.23 75.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.826 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -55.79 -25.92 43.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.427 HD11 ' HD3' ' A' ' 474' ' ' ARG . 64.7 mt -54.58 -33.63 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.6 tt -66.66 -26.12 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.179 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -93.26 -59.65 1.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.845 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 81.8 p -55.09 122.53 11.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.176 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -145.29 -150.65 5.25 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.467 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -117.99 118.59 32.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 110.904 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp 55.58 71.82 1.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.594 0.711 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -18.98 36.83 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.749 2.3 . . . . 0.0 112.347 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 23.0 t -123.87 35.68 4.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.879 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 65.82 -179.81 10.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.75 143.25 50.3 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.715 2.277 . . . . 0.0 112.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 34.5 t -143.72 159.99 41.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.897 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.4 t -96.03 -71.13 0.69 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.865 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 CA-C-O 119.133 -0.815 . . . . 0.0 112.494 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.481 -0.247 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 62.2 m -115.7 -179.71 3.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.872 0.367 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.7 t -81.21 165.99 21.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.8 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -150.63 138.85 6.89 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.523 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.3 t -118.75 59.6 0.82 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.927 0.394 . . . . 0.0 110.885 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.0 t -103.04 42.23 1.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.827 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -158.81 125.79 1.57 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.492 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 4.2 p -134.91 105.96 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 0.0 111.127 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -152.72 168.72 31.73 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -109.63 -28.15 9.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.906 0.384 . . . . 0.0 110.892 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -167.32 72.85 1.0 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.62 0.724 . . . . 0.0 110.899 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 134.09 27.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.678 2.252 . . . . 0.0 112.371 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.585 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.5 m-85 -82.23 138.89 34.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.926 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -117.79 130.28 56.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.0 t -74.69 121.14 21.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -82.7 0.78 41.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -88.84 -41.67 12.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.871 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 12.1 p -125.09 -38.22 2.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.832 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.54 23.09 5.81 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.459 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -89.85 113.89 25.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.891 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.6 t -85.33 144.83 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.099 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -125.77 171.88 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.863 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -84.42 -52.7 5.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -110.01 177.45 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.835 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -80.0 -42.75 23.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.8 t -52.1 -43.35 63.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -57.37 -37.16 72.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.0 tp -77.41 -35.42 54.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.991 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.87 -52.62 56.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -68.69 -26.15 65.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.9 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.658 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.8 t60 -69.79 -39.07 76.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.798 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -54.92 -26.67 37.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.944 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.33 -40.7 68.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.911 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.658 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt -57.88 -24.65 23.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.091 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -100.19 -69.57 0.77 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.89 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 7.8 t -94.78 155.73 16.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.153 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -150.4 55.84 0.47 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.458 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -105.09 69.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.958 0.409 . . . . 0.0 110.923 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -145.98 72.85 13.56 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.568 0.699 . . . . 0.0 110.937 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 -42.69 3.28 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.727 2.285 . . . . 0.0 112.348 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 13.4 m -76.83 130.96 38.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.823 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -59.66 -174.0 0.75 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.471 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 149.01 66.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.252 . . . . 0.0 112.366 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.1 p -107.0 165.36 11.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 9.6 t -105.18 145.5 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.862 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 CA-C-O 119.148 -0.807 . . . . 0.0 112.475 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 82.7 p -74.48 130.12 39.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.84 0.352 . . . . 0.0 110.902 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 41.3 t -118.88 56.44 0.9 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.843 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 179.15 176.74 47.16 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.527 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 4.1 t -151.85 155.58 38.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.85 0.357 . . . . 0.0 110.85 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 35.7 m -137.25 129.18 29.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.85 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -86.08 -60.36 1.76 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.468 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 10.4 t -168.15 155.25 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.124 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 160.26 -177.28 36.77 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.47 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -122.39 116.75 24.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.934 0.397 . . . . 0.0 110.885 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.4 tmtt? -151.32 71.32 8.4 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.562 0.696 . . . . 0.0 110.875 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 135.76 31.28 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.7 2.267 . . . . 0.0 112.342 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.587 ' HB3' HD22 ' A' ' 472' ' ' LEU . 39.3 m-85 -79.31 141.97 36.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 465' ' ' VAL . 69.4 tttt -124.47 108.93 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 3.7 t -51.99 118.19 3.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.874 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.0 t-160 -84.26 0.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.852 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.05 -40.4 12.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.7 p -122.93 -35.61 3.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 108.81 25.19 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.526 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -92.07 126.69 37.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.442 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.7 t -91.47 148.68 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.085 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -135.21 162.56 32.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -78.77 -63.61 1.37 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 40.4 mmm-85 -99.33 167.13 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -69.74 -34.06 73.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.1 m -61.07 -46.94 88.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -52.36 -32.11 36.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.587 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -82.07 -34.9 29.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.961 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.79 -53.96 51.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -62.78 -27.26 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.82 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.637 ' O ' HG22 ' A' ' 478' ' ' ILE . 69.8 t60 -72.61 -38.05 67.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -56.25 -25.31 47.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 55.2 mt -55.32 -28.94 57.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.637 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.9 tt -72.13 -26.57 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -91.02 -45.81 8.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.875 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 10.0 t -122.78 150.64 42.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.118 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.61 -137.41 7.76 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.468 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -148.28 117.49 6.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.964 0.411 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 13.3 tptp 53.99 71.69 1.3 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 83.31 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.33 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 41.2 t -73.23 -48.43 35.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 143.45 170.38 13.14 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.468 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 165.0 32.47 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.662 2.242 . . . . 0.0 112.346 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.5 m -93.56 56.42 2.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.874 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 2.1 m -71.51 112.01 7.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.855 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 119.127 -0.818 . . . . 0.0 112.493 -179.975 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.5 t -93.98 95.06 8.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.82 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 84.1 p -155.99 127.31 7.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 153.62 152.7 6.13 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.512 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 t -164.27 125.87 2.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.87 0.367 . . . . 0.0 110.856 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.1 p -80.87 114.91 20.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.875 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 146.87 155.67 6.63 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.529 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 8.7 t -151.56 152.6 33.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 111.144 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -108.32 -58.92 0.55 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.467 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.81 -175.9 6.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.402 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -174.03 68.51 0.32 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.635 0.731 . . . . 0.0 110.922 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 140.35 42.53 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.7 2.266 . . . . 0.0 112.332 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -75.79 141.93 42.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 56.0 tttt -120.8 109.84 15.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.897 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.3 t -51.97 118.45 3.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -84.15 2.41 39.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -89.96 -41.12 11.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.6 p -123.99 -36.41 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.62 5.54 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -90.87 129.18 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 0.0 110.854 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.12 149.99 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.113 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -141.36 148.78 40.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -55.07 -72.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.858 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -100.85 -175.14 2.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -86.36 -32.83 20.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.851 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.38 -33.87 55.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -74.09 -37.53 64.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.874 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 tp -73.1 -35.34 66.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.78 -49.69 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.093 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -74.2 -25.85 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.694 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.7 t60 -70.95 -22.29 62.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -74.26 -20.5 60.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 43.5 mt -66.29 -38.97 89.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.7 tt -56.72 -24.16 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.14 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -87.21 -25.95 23.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 61.2 p -100.13 166.69 10.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.101 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -139.16 100.65 0.29 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.506 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -60.76 110.0 1.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 0.0 110.856 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -161.37 72.89 2.57 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.603 0.716 . . . . 0.0 110.918 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -42.67 3.17 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.672 2.248 . . . . 0.0 112.333 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 2.9 p -55.91 170.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.855 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -176.42 -75.09 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.475 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 97.65 0.65 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.674 2.249 . . . . 0.0 112.397 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 9.0 p -54.43 162.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.836 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 82.5 p -107.77 34.46 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.785 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 CA-C-O 119.132 -0.815 . . . . 0.0 112.474 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.46 -0.256 . . . . 0.0 112.46 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 90.1 p -96.31 35.38 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 20.2 p -161.27 129.6 4.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.89 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -72.52 -147.81 0.78 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.496 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 27.2 p -99.85 87.79 3.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.862 0.363 . . . . 0.0 110.863 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 11.1 t -103.38 -68.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.865 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 141.77 141.83 3.99 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.483 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.3 m -79.5 -28.7 41.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.861 0.362 . . . . 0.0 111.182 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -82.09 -62.28 1.92 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.493 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 56.07 26.3 9.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.891 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.2 160.7 0.12 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.592 0.71 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.83 148.01 63.67 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.273 . . . . 0.0 112.311 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.419 ' HB3' HD22 ' A' ' 472' ' ' LEU . 43.1 m-85 -70.51 136.33 49.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.941 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 19.4 tttp -115.53 111.28 20.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.863 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -54.02 120.88 6.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -85.73 4.3 37.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.869 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -89.99 -46.44 8.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.899 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.88 -34.17 3.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.78 23.61 5.55 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.483 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -90.48 126.9 36.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.829 0.347 . . . . 0.0 110.873 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.8 t -92.3 149.34 4.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.138 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -140.97 139.98 34.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.5 ttt-85 -52.37 -66.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -103.01 169.39 8.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -72.77 -32.72 65.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 88.7 p -52.09 -37.96 55.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -70.1 -34.75 73.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.3 tp -75.98 -31.23 58.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.946 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -58.12 -56.67 19.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.58 -26.78 67.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.654 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.3 t60 -67.22 -40.15 86.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -55.91 -25.66 43.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.924 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 68.9 mt -54.76 -33.42 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.7 tt -67.46 -25.84 34.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -92.65 -57.32 2.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.879 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 8.9 t -117.7 129.95 56.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -153.49 -111.07 0.43 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.492 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -160.23 140.55 11.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp 53.17 73.29 0.96 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.62 0.724 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 121.36 8.05 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.742 2.294 . . . . 0.0 112.343 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 12.4 p -91.84 114.57 27.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.842 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -158.19 173.62 35.37 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.518 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -29.42 23.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.711 2.274 . . . . 0.0 112.326 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 80.6 p -59.95 168.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.834 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 21.0 m -128.41 148.43 50.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 CA-C-O 119.114 -0.826 . . . . 0.0 112.496 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 112.522 -0.231 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 15.0 m -82.39 172.18 13.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.865 0.364 . . . . 0.0 110.869 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 97.2 p -108.81 137.43 46.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.858 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -95.86 83.92 0.86 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.53 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 79.5 p -127.48 125.41 40.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.851 0.358 . . . . 0.0 110.893 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.0 p -76.32 89.66 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.832 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 71.71 -156.38 52.63 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.462 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.8 m -110.67 -51.34 2.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.831 0.348 . . . . 0.0 111.167 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 83.37 -92.79 1.68 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -103.54 143.7 32.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.876 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.82 69.63 64.89 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.602 0.715 . . . . 0.0 110.919 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 122.5 9.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.657 2.238 . . . . 0.0 112.345 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -71.37 145.92 49.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.863 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 465' ' ' VAL . 74.9 tttt -126.46 122.55 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -62.66 120.8 11.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -85.38 3.97 37.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.04 -45.78 8.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.942 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.3 p -120.52 -33.26 3.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.26 5.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -94.41 126.33 39.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.811 0.338 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.434 HG22 ' HG3' ' A' ' 458' ' ' LYS . 43.2 t -93.2 147.33 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.151 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -132.89 173.17 11.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -75.64 -73.26 0.27 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.846 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.53 160.59 15.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -52.0 -36.48 50.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.0 m -54.3 -49.95 68.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -56.24 -29.75 61.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.4 tp -81.88 -36.48 28.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.909 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.87 -51.87 64.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -65.4 -27.23 68.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.64 ' O ' HG22 ' A' ' 478' ' ' ILE . 81.1 t60 -72.35 -40.14 67.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -56.01 -25.42 44.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.0 mt -55.33 -28.84 56.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.0 tt -72.16 -26.66 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -92.75 -54.32 3.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 66.8 p -51.78 105.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.116 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.65 -34.47 6.93 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.502 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -139.67 171.94 13.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.905 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 18.8 mttm -127.5 160.7 59.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.545 0.688 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -45.96 1.39 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.361 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 7.3 m -68.31 157.77 34.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 156.25 -71.58 0.26 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 84.16 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.658 2.238 . . . . 0.0 112.319 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.4 p -96.79 146.07 25.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.823 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 4.0 m -166.24 155.98 11.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.869 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 CA-C-O 119.104 -0.831 . . . . 0.0 112.518 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.458 -0.257 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 4.4 p 55.41 28.29 11.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 0.0 110.879 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 5.3 m -112.4 79.62 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.831 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -105.66 102.18 1.95 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.495 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 12.8 m -100.1 163.64 12.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.866 0.365 . . . . 0.0 110.886 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 85.6 p -140.9 154.82 46.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.837 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 151.56 91.25 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.537 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.02 130.6 34.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 0.0 111.151 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 93.13 52.5 2.04 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.446 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -151.76 139.09 19.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.945 0.403 . . . . 0.0 110.886 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt 63.26 160.63 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.538 0.685 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 133.42 25.45 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.362 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.435 ' HB3' HD22 ' A' ' 472' ' ' LEU . 51.6 m-85 -77.83 142.01 38.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.924 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -121.4 126.38 49.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 17.9 t -66.67 115.2 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.911 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -77.62 -5.93 52.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.0 -54.77 5.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.7 p -111.2 -36.7 5.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.34 27.22 3.99 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -95.45 127.0 41.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.6 150.02 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.109 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -134.48 -177.18 4.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -90.17 -73.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.58 164.34 12.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -65.12 -31.0 71.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 20.9 t -61.56 -46.03 91.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -55.89 -34.25 65.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.435 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -80.36 -40.3 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.956 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.77 -38.57 56.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.98 -25.95 36.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.702 ' O ' HG22 ' A' ' 478' ' ' ILE . 74.1 t60 -70.56 -28.89 65.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.839 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.73 -24.83 67.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.866 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.41 -44.02 75.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.939 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.702 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt -57.97 -22.65 19.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -90.38 -48.48 7.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.842 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 10.2 t -104.37 45.99 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.166 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -135.43 -172.31 12.66 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.469 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -112.55 -42.82 3.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.881 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 5.6 tppt? 63.24 73.06 0.52 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.541 0.686 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 117.75 5.27 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.682 2.255 . . . . 0.0 112.35 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 97.1 p -122.4 178.3 5.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -89.57 167.12 33.5 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -48.23 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.675 2.25 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.6 t -126.76 98.82 5.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.4 p -167.24 157.43 11.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 119.114 -0.826 . . . . 0.0 112.53 179.992 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 11.5 t -142.88 126.72 17.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.851 0.357 . . . . 0.0 110.881 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.0 t -84.73 62.89 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 91.47 -142.87 16.28 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.477 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 t 54.1 47.55 23.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 0.0 110.856 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.3 m -112.54 -65.38 1.19 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.865 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 175.92 150.2 7.92 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.504 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.0 t -114.43 72.0 0.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 111.145 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 96.44 -176.69 32.85 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.51 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.48 -31.61 70.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 110.888 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt 53.46 68.95 2.51 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.55 0.69 . . . . 0.0 110.866 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 127.54 14.75 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.699 2.266 . . . . 0.0 112.347 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.467 ' HB3' HD22 ' A' ' 472' ' ' LEU . 65.4 m-85 -76.55 137.97 39.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -120.63 119.77 33.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.928 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -61.37 120.7 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -85.04 3.62 37.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.882 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -89.98 -44.03 10.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.2 p -122.7 -35.89 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 24.37 5.54 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.48 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -90.92 127.0 36.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.897 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 39.0 t -92.47 147.48 5.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.075 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -131.7 170.92 14.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.863 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -81.85 -65.98 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 45.3 mtp85 -106.73 156.47 18.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.841 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -51.92 -42.17 62.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.8 t -52.41 -46.8 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -55.05 -31.12 60.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.81 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.5 tp -82.89 -31.92 27.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.14 -51.66 69.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -65.3 -28.72 69.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.648 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.5 t60 -69.53 -39.28 77.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -56.77 -24.64 51.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.919 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 53.6 mt -55.89 -26.04 45.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.648 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.4 tt -76.7 -25.94 16.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -92.23 -33.71 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.85 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 69.1 p -79.42 90.91 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -88.03 -133.5 4.27 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.537 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -79.37 151.98 30.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.933 0.397 . . . . 0.0 110.876 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 160.67 30.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.615 0.722 . . . . 0.0 110.871 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 102.09 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.729 2.286 . . . . 0.0 112.313 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.5 m -141.98 142.96 32.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.874 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -141.31 72.56 0.4 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.513 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -26.03 28.07 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.673 2.249 . . . . 0.0 112.373 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.11 105.91 0.37 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.842 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 12.9 t -113.9 -31.61 6.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.876 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.104 -0.831 . . . . 0.0 112.459 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 77.3 p -158.39 121.42 3.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 110.842 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 7.6 t -163.77 154.47 15.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.852 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 176.59 -165.48 35.78 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.475 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.1 m -132.1 118.73 20.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.844 0.354 . . . . 0.0 110.875 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 40.5 m -152.19 124.19 8.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 99.25 89.04 1.98 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.478 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 3.2 t -151.6 149.19 28.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 111.145 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 151.26 157.24 7.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.462 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -78.28 136.17 37.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.869 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -117.7 160.64 37.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.577 0.703 . . . . 0.0 110.903 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 119.79 6.68 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.707 2.272 . . . . 0.0 112.332 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.56 ' HB3' HD22 ' A' ' 472' ' ' LEU . 17.5 m-85 -79.61 147.05 32.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.451 ' HG3' HG22 ' A' ' 465' ' ' VAL . 21.5 tttp -119.46 110.44 16.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.8 t -52.87 118.13 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -83.98 2.23 39.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.92 -42.42 11.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.56 -35.31 3.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.861 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.18 22.39 6.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.486 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -91.2 129.6 37.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.451 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.1 t -96.41 148.87 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.106 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -130.34 -177.36 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -82.88 -58.48 2.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.874 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -126.58 169.72 12.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.836 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -53.79 -45.8 70.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 60.6 m -52.36 -52.29 54.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -55.01 -27.89 47.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -84.88 -31.11 23.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.9 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.094 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -55.78 -27.37 50.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.633 ' O ' HG22 ' A' ' 478' ' ' ILE . 75.4 t60 -78.47 -36.4 45.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -55.7 -25.9 42.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 58.2 mt -54.78 -32.1 59.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.913 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt -68.13 -26.61 34.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.086 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -94.05 -62.43 1.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 14.2 t -112.81 147.16 37.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 179.47 -147.88 7.83 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -133.25 152.1 51.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.867 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -128.97 70.89 81.76 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.572 0.701 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 110.51 2.57 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 3.8 m 56.86 32.92 22.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -104.23 -168.12 24.88 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.517 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 140.26 42.2 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.71 2.274 . . . . 0.0 112.319 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 30.9 t -110.16 -42.7 4.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 9.3 p 53.51 33.98 17.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.874 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.493 179.994 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 42.6 m -105.94 136.45 45.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.86 0.362 . . . . 0.0 110.884 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.97 105.3 5.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -156.31 164.61 32.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.481 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.1 m -106.95 -64.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 110.842 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 61.3 m -108.18 101.87 11.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.863 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -146.63 -83.46 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.498 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 4.3 m -110.22 115.36 29.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.809 0.338 . . . . 0.0 111.179 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 106.6 143.19 11.15 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -83.72 161.08 21.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.39 . . . . 0.0 110.94 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -137.23 69.43 55.62 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.619 0.723 . . . . 0.0 110.925 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 125.78 12.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.643 2.228 . . . . 0.0 112.348 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.437 ' HB3' HD22 ' A' ' 472' ' ' LEU . 24.1 m-85 -78.22 146.86 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 50.3 tttt -125.54 122.04 35.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.4 t -62.92 119.01 8.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -83.82 2.07 40.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -90.06 -42.87 10.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 23.0 p -121.99 -34.9 3.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 109.52 23.49 6.26 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.523 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -90.73 127.14 36.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.96 149.82 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.127 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -135.38 162.2 33.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 44.9 ttm-85 -70.56 -56.71 5.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -116.47 179.79 3.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.82 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -81.8 -26.53 34.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 62.3 p -60.89 -38.79 86.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -69.58 -39.12 77.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.876 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.437 HD22 ' HB3' ' A' ' 457' ' ' TYR . 6.4 tp -72.15 -37.69 69.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.76 -45.97 63.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -77.58 -26.11 50.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.859 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.664 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.9 t60 -68.32 -26.9 65.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -67.59 -25.92 66.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.916 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.19 -43.31 70.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.9 tt -56.73 -24.63 19.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -89.91 -26.28 20.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 69.9 p -95.08 124.81 39.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -158.4 -67.5 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -133.72 139.84 46.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.885 0.374 . . . . 0.0 110.872 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -139.17 160.66 61.43 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.579 0.704 . . . . 0.0 110.897 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 96.47 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.67 2.247 . . . . 0.0 112.311 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 6.0 p -113.77 -57.21 2.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.859 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -93.76 -74.51 1.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.494 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 98.55 0.69 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.694 2.262 . . . . 0.0 112.365 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.4 t -94.82 -59.4 1.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.0 p 55.45 27.63 10.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 119.116 -0.824 . . . . 0.0 112.433 -179.933 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.1 p -138.72 138.87 38.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.887 0.375 . . . . 0.0 110.811 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 23.1 t -61.91 -41.99 98.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.844 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 81.71 -95.86 1.74 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.455 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 5.6 p -141.34 152.14 44.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 0.0 110.862 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 59.8 m -143.13 122.11 12.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -96.53 26.72 20.53 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.488 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 21.0 p -95.6 168.6 10.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.849 0.357 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 161.61 -115.92 0.68 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -166.34 139.78 4.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.873 0.368 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -127.99 160.67 60.24 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.596 0.712 . . . . 0.0 110.901 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 138.53 38.11 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.679 2.253 . . . . 0.0 112.352 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.54 ' HB3' HD22 ' A' ' 472' ' ' LEU . 28.9 m-85 -77.59 143.53 38.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -122.01 120.13 33.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.2 119.06 8.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -83.28 -0.1 48.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -87.42 -42.88 12.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.5 p -122.58 -36.19 2.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.841 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.4 21.72 6.42 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.494 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.7 mttm -88.51 127.05 35.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 25.3 t -90.96 148.71 4.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -136.46 143.03 43.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -56.56 -64.24 0.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.882 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -103.47 -177.1 3.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.933 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -85.54 -32.46 22.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -54.67 -41.69 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.831 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -64.43 -39.03 93.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.54 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.2 tp -71.75 -39.0 70.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -53.41 -48.71 68.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.115 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -72.75 -26.37 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.87 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.5 t60 -68.45 -37.65 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -56.09 -26.0 47.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.6 mt -53.62 -43.91 69.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.897 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.1 tt -57.54 -24.41 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.174 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -96.62 -69.98 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 8.7 t -105.59 143.89 33.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.112 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -169.29 147.44 11.07 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.517 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -73.74 143.42 46.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 11.1 mptt 52.83 72.25 1.22 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.9 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 113.24 3.31 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.666 2.244 . . . . 0.0 112.354 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 7.2 t -82.37 122.75 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.861 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 148.44 71.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.508 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -43.46 2.66 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.681 2.254 . . . . 0.0 112.334 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.4 m -75.18 88.48 2.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 4.3 m -114.26 127.77 56.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.829 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 CA-C-O 119.154 -0.803 . . . . 0.0 112.509 -179.958 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.7 p -145.2 133.38 21.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 110.859 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 26.6 t -171.8 152.08 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 161.5 103.36 0.18 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.491 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.61 172.07 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.871 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 67.4 p -155.41 132.84 11.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.93 20.54 4.04 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.5 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 32.5 p -69.8 140.91 53.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.853 0.359 . . . . 0.0 111.147 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -140.48 90.05 0.19 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.459 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -115.22 31.04 6.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.875 0.369 . . . . 0.0 110.823 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.22 160.7 82.04 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.521 0.677 . . . . 0.0 110.908 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 111.13 2.73 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.243 . . . . 0.0 112.316 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.509 ' HB3' HD22 ' A' ' 472' ' ' LEU . 74.2 m-85 -74.7 137.37 42.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.916 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -117.28 128.21 54.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.866 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.68 119.25 13.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -82.98 1.23 40.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -88.75 -44.2 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.8 p -122.11 -35.03 3.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 21.67 6.62 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.47 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -88.05 124.32 33.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.7 t -92.14 149.56 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.115 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -130.19 -175.87 3.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 -28.46 6.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 56.9 mtt-85 -122.59 136.69 54.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -53.87 -34.97 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 65.7 m -64.97 -40.11 94.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.866 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 39.1 m170 -59.16 -32.4 69.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.509 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.8 tp -78.72 -35.06 45.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.33 -51.8 67.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.087 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -66.57 -28.21 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.65 ' O ' HG22 ' A' ' 478' ' ' ILE . 67.9 t60 -70.04 -40.81 74.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -56.08 -25.31 44.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.34 -33.59 63.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt -67.0 -25.0 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -93.12 -53.56 4.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.875 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 20.7 p -72.57 124.17 24.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -141.12 93.8 0.19 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.471 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -129.51 60.29 1.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 0.0 110.861 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 56.75 73.66 0.78 Allowed Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.588 0.709 . . . . 0.0 110.868 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -179.21 2.76 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.647 2.231 . . . . 0.0 112.391 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 24.1 p -142.6 126.01 16.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -135.75 175.62 20.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.5 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 155.99 64.5 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.724 2.283 . . . . 0.0 112.306 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 91.8 p -116.35 177.93 4.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 15.4 t -93.07 125.24 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 CA-C-O 119.148 -0.807 . . . . 0.0 112.443 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 36.7 t -95.25 78.29 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.858 0.361 . . . . 0.0 110.89 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 44.8 t -123.63 154.8 38.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.854 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -147.53 -134.75 2.55 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.513 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.7 t -167.33 127.69 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.886 0.374 . . . . 0.0 110.834 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 22.2 m -114.61 86.32 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.864 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -135.2 73.14 0.45 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.518 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 38.8 m -88.78 85.69 6.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.797 0.332 . . . . 0.0 111.098 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 175.36 169.25 36.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.484 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -83.52 108.18 16.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.95 0.405 . . . . 0.0 110.896 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -84.71 160.71 55.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.569 0.7 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 121.16 7.85 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.658 2.239 . . . . 0.0 112.323 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.733 ' HB3' HD22 ' A' ' 472' ' ' LEU . 44.0 m-85 -85.29 142.13 29.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.956 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.406 ' HG3' HG22 ' A' ' 465' ' ' VAL . 42.2 tttp -121.05 131.26 54.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.899 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 6.2 t -70.69 120.03 15.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.864 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -85.32 -0.3 54.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.91 -34.58 16.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 9.1 p -128.6 -39.36 1.65 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.65 22.29 5.79 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 15.9 mtmm -92.64 124.89 36.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.826 0.346 . . . . 0.0 110.885 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.406 HG22 ' HG3' ' A' ' 458' ' ' LYS . 42.1 t -94.39 146.73 6.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.119 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -124.48 -175.85 3.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.78 -49.82 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.849 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -119.34 148.22 43.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -52.0 -39.84 60.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.4 p -56.5 -39.31 73.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.815 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -68.0 -30.44 69.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.1 tp -80.67 -39.18 27.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.939 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.12 -48.16 76.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.137 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 37.0 mmm-85 -63.22 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.652 ' O ' HG22 ' A' ' 478' ' ' ILE . 78.8 t60 -74.55 -39.12 62.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.898 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -55.85 -25.55 42.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.05 -31.95 61.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.652 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.1 tt -69.25 -25.62 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -92.02 -44.12 9.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 11.2 t -135.84 133.9 38.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.181 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -164.83 121.12 0.98 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.475 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -87.98 90.04 8.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.916 0.388 . . . . 0.0 110.882 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.9 tptt 57.55 73.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.593 0.711 . . . . 0.0 110.859 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 90.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.698 2.265 . . . . 0.0 112.333 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.8 p -65.72 -60.61 2.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.881 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -59.81 176.12 3.49 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.469 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 140.1 41.76 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.682 2.255 . . . . 0.0 112.364 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 4.1 m -128.66 -179.68 5.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.822 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 3.1 p -71.79 -36.58 70.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.436 179.988 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 16.7 t -123.25 -37.35 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.923 0.392 . . . . 0.0 110.876 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 2.1 m -96.27 147.82 23.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.884 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -152.82 82.13 0.17 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.462 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 63.2 m -66.18 -176.57 0.43 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.888 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 -63.94 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.47 135.04 2.99 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.471 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 16.2 p -92.86 124.34 36.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.757 0.313 . . . . 0.0 111.208 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -145.71 175.21 25.35 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.505 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.08 156.04 39.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.392 . . . . 0.0 110.883 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -123.85 70.25 48.48 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.533 0.683 . . . . 0.0 110.887 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 133.4 25.49 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 0.0 112.365 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.591 ' HB3' HD22 ' A' ' 472' ' ' LEU . 33.6 m-85 -77.23 143.34 39.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.919 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.496 ' HG3' HG22 ' A' ' 465' ' ' VAL . 40.7 tttt -123.74 111.2 15.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.8 t -51.98 120.19 5.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -85.77 4.44 36.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -90.08 -45.33 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 21.2 p -121.88 -34.73 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.19 23.97 5.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.507 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -90.21 129.43 36.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.496 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.8 t -95.71 149.91 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -137.41 157.77 45.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.867 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -63.7 -72.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -101.8 178.28 4.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -75.57 -35.13 60.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.0 p -52.23 -50.72 61.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -58.15 -38.87 77.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.591 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.3 tp -70.71 -28.95 65.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.876 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.75 11.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.087 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -59.54 -26.3 65.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.624 ' O ' HG22 ' A' ' 478' ' ' ILE . 85.6 t60 -83.33 -18.71 38.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.32 -17.54 51.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 10.6 mt -95.7 26.27 4.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.1 tt -114.04 -26.63 2.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.133 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -87.47 -38.68 15.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.84 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 2.2 t -108.55 151.0 26.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.143 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 153.93 -88.07 0.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.482 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -98.22 67.67 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.892 0.377 . . . . 0.0 110.866 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -163.64 73.45 1.83 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.565 0.697 . . . . 0.0 110.867 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 121.85 8.53 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 10.6 p -57.39 156.59 7.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -141.69 172.0 24.17 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.48 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 108.9 2.19 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.653 2.235 . . . . 0.0 112.355 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 59.0 p -106.93 -37.78 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.889 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 1.8 t -125.53 144.9 50.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.847 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 CA-C-O 119.136 -0.813 . . . . 0.0 112.512 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 19.0 m -121.57 179.01 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.843 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 14.2 t -129.07 133.82 47.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -57.91 107.49 1.08 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.474 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.5 p -70.8 -53.65 14.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.829 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.7 p -96.25 153.97 17.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -137.81 -110.33 0.96 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.448 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 8.0 t -145.86 142.38 28.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.834 0.349 . . . . 0.0 111.12 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -154.3 -161.6 10.57 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.476 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -103.16 -38.38 7.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.925 0.393 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -152.33 68.32 7.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.622 0.725 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 122.94 9.63 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.481 ' HB3' HD22 ' A' ' 472' ' ' LEU . 27.2 m-85 -78.2 147.94 34.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.947 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -128.98 112.09 13.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.913 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.2 t -57.4 120.61 8.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -81.8 -12.81 58.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -69.39 -45.27 69.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.874 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 6.9 p -119.3 -42.0 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.23 23.93 4.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.481 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -91.77 137.41 32.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.798 0.332 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.24 150.11 5.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -135.0 161.99 33.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -62.01 -73.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -113.44 -176.25 2.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.838 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -70.0 -36.94 75.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 -37.99 68.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -68.29 -45.46 72.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.841 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.481 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.8 tp -67.41 -32.46 73.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.0 -53.9 36.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.112 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 22.4 mmt-85 -64.22 -26.26 68.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.583 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.9 t60 -77.37 -23.94 50.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.841 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -72.91 -10.32 59.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.23 25.16 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.889 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.3 tt -112.79 -26.71 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -85.55 -37.51 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 70.7 p -58.04 -37.34 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 107.19 173.65 22.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.495 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -110.54 -70.07 0.83 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -133.41 160.27 69.28 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.552 0.691 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -13.85 35.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.7 2.267 . . . . 0.0 112.348 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 21.2 m -76.13 143.9 40.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.843 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 146.28 172.65 16.8 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.504 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 83.76 0.68 Allowed 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.68 2.253 . . . . 0.0 112.329 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.1 m -78.65 84.14 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.833 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 15.8 m -152.73 161.35 42.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.854 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 CA-C-O 119.166 -0.797 . . . . 0.0 112.528 -179.959 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.4 p -86.34 93.5 9.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.834 0.35 . . . . 0.0 110.895 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 22.3 t -148.49 147.48 29.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.868 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 96.03 127.78 5.47 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.46 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 43.4 t -144.92 153.27 41.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.849 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 5.0 m -135.27 171.55 14.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.88 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 146.98 78.57 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.48 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 29.2 m -156.02 130.08 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.837 0.351 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -154.22 77.21 0.21 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.485 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -98.85 28.44 4.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.947 0.403 . . . . 0.0 110.893 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -65.64 160.65 59.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.571 0.7 . . . . 0.0 110.929 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 129.08 17.01 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.364 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.723 ' HB3' HD22 ' A' ' 472' ' ' LEU . 42.4 m-85 -76.16 138.48 40.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.936 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -119.27 129.89 55.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.31 119.29 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.917 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -79.46 -7.63 58.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.849 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.4 -49.09 17.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.937 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.1 p -117.2 -40.35 3.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.79 21.41 4.63 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.46 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -88.46 128.09 35.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.815 0.34 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.81 146.85 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.129 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -127.02 -176.42 3.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -94.03 -67.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -105.58 150.99 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -52.0 -30.05 23.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.9 t -58.28 -49.89 75.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.859 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -57.41 -44.09 84.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.723 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.0 tp -67.36 -32.39 73.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.898 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.04 -54.63 27.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.064 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.57 -26.05 68.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.614 ' O ' HG22 ' A' ' 478' ' ' ILE . 83.0 t60 -79.43 -18.73 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.847 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -79.49 -16.77 55.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 12.7 mt -95.67 25.96 4.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.614 HG22 ' O ' ' A' ' 475' ' ' HIS . 9.8 tt -112.89 -26.67 2.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -89.37 -37.84 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 57.5 p -52.49 119.86 4.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.184 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 161.02 -89.15 0.11 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.515 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 57.69 46.08 17.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 0.0 110.845 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -161.68 71.49 2.46 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.54 0.686 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 119.62 6.54 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.657 2.238 . . . . 0.0 112.357 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 15.4 m -59.28 127.24 31.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.833 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -148.81 -176.2 21.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.461 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 101.6 0.93 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.722 2.281 . . . . 0.0 112.346 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 49.5 m -54.76 152.97 6.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 13.7 t -162.18 111.32 1.46 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.871 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-O 119.154 -0.803 . . . . 0.0 112.506 -179.992 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.449 -0.26 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 11.1 p -111.26 66.74 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.382 . . . . 0.0 110.841 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 7.8 t -57.77 144.32 38.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 93.2 37.88 5.53 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.456 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 11.7 t -85.74 96.84 9.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.888 0.375 . . . . 0.0 110.819 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 52.8 m -54.9 158.09 2.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.869 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -101.57 105.6 2.89 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 14.8 t -95.83 167.88 10.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.872 0.368 . . . . 0.0 111.13 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -87.73 81.39 1.62 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.495 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -80.22 118.67 22.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 110.905 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? 52.14 68.38 3.21 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.526 0.679 . . . . 0.0 110.877 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 126.03 12.81 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.678 2.252 . . . . 0.0 112.31 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 457' ' ' TYR . . . . . 0.47 ' HB3' HD22 ' A' ' 472' ' ' LEU . 77.2 m-85 -66.28 141.87 57.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.905 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 458' ' ' LYS . . . . . 0.466 ' HG3' HG22 ' A' ' 465' ' ' VAL . 77.2 tttt -127.79 109.73 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.897 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.6 t -53.17 119.37 4.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 25.3 p-80 -81.1 -16.39 53.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.837 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.68 -47.19 82.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 7.5 p -118.07 -41.74 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.88 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.61 27.04 2.92 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.2 mttm -95.75 132.27 41.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.823 0.344 . . . . 0.0 110.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 ' HG3' ' A' ' 458' ' ' LYS . 46.5 t -94.57 147.05 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -129.66 139.39 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.849 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -52.09 -44.68 64.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.877 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -135.59 170.03 16.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.867 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -67.58 -36.81 81.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.926 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 4.9 p -52.11 -34.95 46.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.865 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -77.63 -34.86 53.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.5 tp -73.03 -28.68 62.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.37 -56.96 15.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.108 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -60.52 -26.05 66.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' HIS . . . . . 0.594 ' O ' HG22 ' A' ' 478' ' ' ILE . 70.7 t60 -79.73 -24.02 41.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -71.8 -9.75 58.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 14.1 mt -98.82 24.64 7.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt -112.57 -26.62 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.17 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -86.65 -36.27 18.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 3.2 t -109.09 -26.74 9.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 53.78 80.46 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.25 -39.34 40.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.383 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -106.56 159.26 30.47 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.571 0.7 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 80.23 0.89 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.659 2.239 . . . . 0.0 112.355 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 3.4 t -168.68 153.93 6.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 148.26 178.02 23.06 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.483 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 -35.43 12.9 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.649 2.233 . . . . 0.0 112.379 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.9 p -112.0 114.96 28.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 6.0 t -79.46 -43.43 23.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.873 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 CA-C-O 119.102 -0.832 . . . . 0.0 112.503 -179.977 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.765 0.235 . . . . 0.0 112.349 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.431 ' HB3' HD22 ' A' ' 472' ' ' LEU . 49.3 m-85 -76.01 146.46 39.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -126.71 119.57 27.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.907 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 14.1 t -62.83 118.92 8.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.923 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 -80.02 -12.19 59.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -69.14 -49.26 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.3 p -117.13 -40.4 3.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 117.12 21.76 4.4 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.455 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -89.78 130.98 35.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 0.0 110.918 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.58 149.91 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.114 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -135.09 150.34 50.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -62.14 -65.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -101.89 -179.83 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.907 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -78.71 -42.16 29.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.6 m -52.09 -43.64 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -57.42 -35.82 70.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.8 tp -76.65 -33.99 58.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.55 -55.17 37.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.105 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -32.47 72.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.1 t60 -67.76 -38.73 83.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -55.18 -26.48 39.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.883 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.4 mt -54.2 -36.4 63.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.204 0 CA-C-O 120.757 0.232 . . . . 0.0 112.358 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -70.15 139.36 52.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 59.2 tttt -118.4 109.15 15.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -51.95 120.78 5.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.872 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -86.01 4.72 36.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -90.05 -43.75 10.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 p -122.8 -35.55 3.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.853 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.93 24.36 5.22 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.505 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -91.99 127.29 37.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.814 0.34 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.9 t -92.07 149.76 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -139.62 156.99 46.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.41 -74.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.878 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 44.1 mtt85 -106.67 155.18 19.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -51.93 -33.35 36.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -53.33 -35.75 60.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.841 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -73.02 -32.07 64.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.8 tp -78.07 -33.09 51.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.76 -53.56 53.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -27.31 66.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 73.7 t60 -66.47 -41.92 88.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -56.82 -24.48 51.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 79.5 mt -55.94 -26.64 48.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.2 tt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.149 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.173 0 CA-C-O 120.851 0.271 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.421 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.0 m-85 -84.52 119.5 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.427 ' HG3' HG22 ' A' ' 465' ' ' VAL . 18.2 tttp -100.41 113.53 26.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.881 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -57.37 121.13 9.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -85.5 4.03 37.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.82 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -90.06 -44.68 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.909 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.43 -35.12 3.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.45 22.63 5.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.483 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -90.92 126.07 35.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.427 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.3 t -91.5 147.87 4.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.182 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -137.09 135.07 37.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -53.2 -62.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -96.53 170.81 8.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -79.08 -30.39 43.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.12 -43.36 87.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.839 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -59.02 -27.08 65.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.877 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -83.53 -36.71 23.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.52 -52.77 60.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -70.73 -26.63 63.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.8 t60 -68.66 -39.79 80.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.853 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -55.75 -25.86 42.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.9 mt -54.52 -35.02 62.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.9 tt . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.161 0 CA-C-O 120.809 0.254 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.605 ' HB3' HD22 ' A' ' 472' ' ' LEU . 34.7 m-85 -86.33 144.72 27.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 13.3 tttm -121.87 126.15 48.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -69.94 120.95 16.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -84.09 1.85 42.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.817 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -89.38 -43.42 10.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.5 p -122.64 -35.8 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.72 23.18 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.511 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttm -89.14 127.83 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.815 0.34 . . . . 0.0 110.936 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 29.1 t -93.86 146.16 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -131.76 156.18 46.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -72.49 -60.9 2.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.829 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.1 mmt-85 -96.92 -177.54 3.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -88.02 -38.46 15.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.5 p -55.79 -44.16 77.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -55.48 -37.73 68.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 457' ' ' TYR . 16.9 tp -74.82 -38.33 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.896 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.17 -53.69 49.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.09 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.427 ' HD3' HD11 ' A' ' 477' ' ' LEU . 20.2 mmt180 -65.19 -28.04 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.646 ' O ' HG22 ' A' ' 478' ' ' ILE . 80.4 t60 -69.64 -41.23 75.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.826 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -55.79 -25.92 43.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.427 HD11 ' HD3' ' A' ' 474' ' ' ARG . 64.7 mt -54.58 -33.63 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.6 tt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.179 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.809 0.254 . . . . 0.0 112.371 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.585 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.5 m-85 -82.23 138.89 34.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.926 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -117.79 130.28 56.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.0 t -74.69 121.14 21.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -82.7 0.78 41.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -88.84 -41.67 12.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.871 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 12.1 p -125.09 -38.22 2.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.832 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.54 23.09 5.81 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.459 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -89.85 113.89 25.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.891 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.6 t -85.33 144.83 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.099 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -125.77 171.88 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.863 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -84.42 -52.7 5.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -110.01 177.45 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.835 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -80.0 -42.75 23.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.8 t -52.1 -43.35 63.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -57.37 -37.16 72.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.0 tp -77.41 -35.42 54.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.991 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.87 -52.62 56.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -68.69 -26.15 65.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.9 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.658 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.8 t60 -69.79 -39.07 76.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.798 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -54.92 -26.67 37.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.944 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.33 -40.7 68.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.911 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.658 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.091 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.152 0 CA-C-O 120.763 0.234 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.587 ' HB3' HD22 ' A' ' 472' ' ' LEU . 39.3 m-85 -79.31 141.97 36.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 465' ' ' VAL . 69.4 tttt -124.47 108.93 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 3.7 t -51.99 118.19 3.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.874 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.0 t-160 -84.26 0.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.852 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.05 -40.4 12.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.7 p -122.93 -35.61 3.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 108.81 25.19 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.526 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -92.07 126.69 37.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.442 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.7 t -91.47 148.68 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.085 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -135.21 162.56 32.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -78.77 -63.61 1.37 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 40.4 mmm-85 -99.33 167.13 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -69.74 -34.06 73.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.1 m -61.07 -46.94 88.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -52.36 -32.11 36.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.587 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -82.07 -34.9 29.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.961 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.79 -53.96 51.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -62.78 -27.26 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.82 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.637 ' O ' HG22 ' A' ' 478' ' ' ILE . 69.8 t60 -72.61 -38.05 67.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -56.25 -25.31 47.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 55.2 mt -55.32 -28.94 57.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.637 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.9 tt . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.77 0.237 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -75.79 141.93 42.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 56.0 tttt -120.8 109.84 15.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.897 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.3 t -51.97 118.45 3.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -84.15 2.41 39.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -89.96 -41.12 11.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.6 p -123.99 -36.41 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.62 5.54 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -90.87 129.18 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 0.0 110.854 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.12 149.99 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.113 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -141.36 148.78 40.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -55.07 -72.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.858 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -100.85 -175.14 2.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -86.36 -32.83 20.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.851 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.38 -33.87 55.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -74.09 -37.53 64.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.874 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 tp -73.1 -35.34 66.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.78 -49.69 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.093 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -74.2 -25.85 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.694 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.7 t60 -70.95 -22.29 62.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -74.26 -20.5 60.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 43.5 mt -66.29 -38.97 89.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.7 tt . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.14 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--O 1.231 0.165 0 CA-C-O 120.754 0.231 . . . . 0.0 112.311 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.419 ' HB3' HD22 ' A' ' 472' ' ' LEU . 43.1 m-85 -70.51 136.33 49.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.941 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 19.4 tttp -115.53 111.28 20.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.863 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -54.02 120.88 6.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -85.73 4.3 37.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.869 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -89.99 -46.44 8.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.899 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.88 -34.17 3.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.78 23.61 5.55 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.483 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -90.48 126.9 36.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.829 0.347 . . . . 0.0 110.873 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.8 t -92.3 149.34 4.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.138 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -140.97 139.98 34.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.5 ttt-85 -52.37 -66.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -103.01 169.39 8.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -72.77 -32.72 65.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 88.7 p -52.09 -37.96 55.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -70.1 -34.75 73.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.3 tp -75.98 -31.23 58.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.946 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -58.12 -56.67 19.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.58 -26.78 67.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.654 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.3 t60 -67.22 -40.15 86.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -55.91 -25.66 43.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.924 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 68.9 mt -54.76 -33.42 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.7 tt . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 N--CA 1.466 -0.13 0 CA-C-O 120.802 0.251 . . . . 0.0 112.345 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -71.37 145.92 49.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.863 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 465' ' ' VAL . 74.9 tttt -126.46 122.55 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -62.66 120.8 11.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -85.38 3.97 37.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.04 -45.78 8.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.942 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.3 p -120.52 -33.26 3.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.26 5.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -94.41 126.33 39.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.811 0.338 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.434 HG22 ' HG3' ' A' ' 458' ' ' LYS . 43.2 t -93.2 147.33 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.151 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -132.89 173.17 11.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -75.64 -73.26 0.27 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.846 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.53 160.59 15.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.0 -36.48 50.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.0 m -54.3 -49.95 68.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -56.24 -29.75 61.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.4 tp -81.88 -36.48 28.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.909 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.87 -51.87 64.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -65.4 -27.23 68.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.64 ' O ' HG22 ' A' ' 478' ' ' ILE . 81.1 t60 -72.35 -40.14 67.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -56.01 -25.42 44.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.0 mt -55.33 -28.84 56.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.0 tt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.755 0.231 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.435 ' HB3' HD22 ' A' ' 472' ' ' LEU . 51.6 m-85 -77.83 142.01 38.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.924 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -121.4 126.38 49.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 17.9 t -66.67 115.2 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.911 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -77.62 -5.93 52.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.0 -54.77 5.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.7 p -111.2 -36.7 5.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.34 27.22 3.99 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -95.45 127.0 41.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.6 150.02 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.109 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -134.48 -177.18 4.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -90.17 -73.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.58 164.34 12.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -65.12 -31.0 71.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 20.9 t -61.56 -46.03 91.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -55.89 -34.25 65.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.435 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -80.36 -40.3 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.956 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.77 -38.57 56.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.98 -25.95 36.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.702 ' O ' HG22 ' A' ' 478' ' ' ILE . 74.1 t60 -70.56 -28.89 65.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.839 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.73 -24.83 67.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.866 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.41 -44.02 75.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.939 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.702 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.14 0 CA-C-O 120.779 0.241 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.467 ' HB3' HD22 ' A' ' 472' ' ' LEU . 65.4 m-85 -76.55 137.97 39.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -120.63 119.77 33.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.928 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -61.37 120.7 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -85.04 3.62 37.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.882 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -89.98 -44.03 10.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.2 p -122.7 -35.89 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 24.37 5.54 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.48 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -90.92 127.0 36.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.897 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 39.0 t -92.47 147.48 5.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.075 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -131.7 170.92 14.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.863 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -81.85 -65.98 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 45.3 mtp85 -106.73 156.47 18.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.841 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -51.92 -42.17 62.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.8 t -52.41 -46.8 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -55.05 -31.12 60.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.81 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.5 tp -82.89 -31.92 27.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.14 -51.66 69.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -65.3 -28.72 69.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.648 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.5 t60 -69.53 -39.28 77.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -56.77 -24.64 51.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.919 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 53.6 mt -55.89 -26.04 45.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.648 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.4 tt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.796 0.248 . . . . 0.0 112.332 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.56 ' HB3' HD22 ' A' ' 472' ' ' LEU . 17.5 m-85 -79.61 147.05 32.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.451 ' HG3' HG22 ' A' ' 465' ' ' VAL . 21.5 tttp -119.46 110.44 16.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.8 t -52.87 118.13 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -83.98 2.23 39.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.92 -42.42 11.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.56 -35.31 3.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.861 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.18 22.39 6.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.486 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -91.2 129.6 37.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.451 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.1 t -96.41 148.87 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.106 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -130.34 -177.36 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -82.88 -58.48 2.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.874 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -126.58 169.72 12.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.836 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -53.79 -45.8 70.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 60.6 m -52.36 -52.29 54.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -55.01 -27.89 47.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -84.88 -31.11 23.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.9 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.094 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -55.78 -27.37 50.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.633 ' O ' HG22 ' A' ' 478' ' ' ILE . 75.4 t60 -78.47 -36.4 45.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -55.7 -25.9 42.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 58.2 mt -54.78 -32.1 59.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.913 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.086 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.796 0.249 . . . . 0.0 112.348 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.437 ' HB3' HD22 ' A' ' 472' ' ' LEU . 24.1 m-85 -78.22 146.86 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 50.3 tttt -125.54 122.04 35.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.4 t -62.92 119.01 8.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -83.82 2.07 40.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -90.06 -42.87 10.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 23.0 p -121.99 -34.9 3.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 109.52 23.49 6.26 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.523 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -90.73 127.14 36.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.96 149.82 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.127 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -135.38 162.2 33.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 44.9 ttm-85 -70.56 -56.71 5.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -116.47 179.79 3.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.82 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -81.8 -26.53 34.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 62.3 p -60.89 -38.79 86.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -69.58 -39.12 77.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.876 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.437 HD22 ' HB3' ' A' ' 457' ' ' TYR . 6.4 tp -72.15 -37.69 69.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.76 -45.97 63.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -77.58 -26.11 50.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.859 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.664 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.9 t60 -68.32 -26.9 65.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -67.59 -25.92 66.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.916 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.19 -43.31 70.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.9 tt . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.231 0.149 0 CA-C-O 120.798 0.249 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.54 ' HB3' HD22 ' A' ' 472' ' ' LEU . 28.9 m-85 -77.59 143.53 38.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -122.01 120.13 33.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.2 119.06 8.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -83.28 -0.1 48.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -87.42 -42.88 12.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.5 p -122.58 -36.19 2.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.841 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.4 21.72 6.42 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.494 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.7 mttm -88.51 127.05 35.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 25.3 t -90.96 148.71 4.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -136.46 143.03 43.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -56.56 -64.24 0.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.882 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -103.47 -177.1 3.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.933 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -85.54 -32.46 22.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -54.67 -41.69 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.831 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -64.43 -39.03 93.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.54 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.2 tp -71.75 -39.0 70.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -53.41 -48.71 68.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.115 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -72.75 -26.37 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.87 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.5 t60 -68.45 -37.65 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -56.09 -26.0 47.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.6 mt -53.62 -43.91 69.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.897 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.1 tt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.174 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.755 0.231 . . . . 0.0 112.316 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.509 ' HB3' HD22 ' A' ' 472' ' ' LEU . 74.2 m-85 -74.7 137.37 42.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.916 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -117.28 128.21 54.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.866 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.68 119.25 13.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -82.98 1.23 40.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -88.75 -44.2 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.8 p -122.11 -35.03 3.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 21.67 6.62 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.47 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -88.05 124.32 33.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.7 t -92.14 149.56 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.115 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -130.19 -175.87 3.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 -28.46 6.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 56.9 mtt-85 -122.59 136.69 54.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -53.87 -34.97 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 65.7 m -64.97 -40.11 94.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.866 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 39.1 m170 -59.16 -32.4 69.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.509 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.8 tp -78.72 -35.06 45.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.33 -51.8 67.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.087 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -66.57 -28.21 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.65 ' O ' HG22 ' A' ' 478' ' ' ILE . 67.9 t60 -70.04 -40.81 74.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -56.08 -25.31 44.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.34 -33.59 63.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.761 0.234 . . . . 0.0 112.323 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.733 ' HB3' HD22 ' A' ' 472' ' ' LEU . 44.0 m-85 -85.29 142.13 29.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.956 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.406 ' HG3' HG22 ' A' ' 465' ' ' VAL . 42.2 tttp -121.05 131.26 54.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.899 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 6.2 t -70.69 120.03 15.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.864 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -85.32 -0.3 54.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.91 -34.58 16.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 9.1 p -128.6 -39.36 1.65 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.65 22.29 5.79 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 15.9 mtmm -92.64 124.89 36.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.826 0.346 . . . . 0.0 110.885 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.406 HG22 ' HG3' ' A' ' 458' ' ' LYS . 42.1 t -94.39 146.73 6.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.119 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -124.48 -175.85 3.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.78 -49.82 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.849 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -119.34 148.22 43.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -52.0 -39.84 60.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.4 p -56.5 -39.31 73.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.815 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -68.0 -30.44 69.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.1 tp -80.67 -39.18 27.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.939 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.12 -48.16 76.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.137 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 37.0 mmm-85 -63.22 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.652 ' O ' HG22 ' A' ' 478' ' ' ILE . 78.8 t60 -74.55 -39.12 62.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.898 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -55.85 -25.55 42.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.05 -31.95 61.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.652 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.1 tt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.134 0 CA-C-O 120.796 0.248 . . . . 0.0 112.365 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.591 ' HB3' HD22 ' A' ' 472' ' ' LEU . 33.6 m-85 -77.23 143.34 39.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.919 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.496 ' HG3' HG22 ' A' ' 465' ' ' VAL . 40.7 tttt -123.74 111.2 15.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.8 t -51.98 120.19 5.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -85.77 4.44 36.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -90.08 -45.33 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 21.2 p -121.88 -34.73 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.19 23.97 5.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.507 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -90.21 129.43 36.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.496 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.8 t -95.71 149.91 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -137.41 157.77 45.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.867 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -63.7 -72.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -101.8 178.28 4.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -75.57 -35.13 60.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.0 p -52.23 -50.72 61.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -58.15 -38.87 77.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.591 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.3 tp -70.71 -28.95 65.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.876 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.75 11.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.087 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -59.54 -26.3 65.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.624 ' O ' HG22 ' A' ' 478' ' ' ILE . 85.6 t60 -83.33 -18.71 38.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.32 -17.54 51.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 10.6 mt -95.7 26.27 4.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.1 tt . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.133 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.171 0 CA-C-O 120.77 0.237 . . . . 0.0 112.337 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.481 ' HB3' HD22 ' A' ' 472' ' ' LEU . 27.2 m-85 -78.2 147.94 34.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.947 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -128.98 112.09 13.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.913 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.2 t -57.4 120.61 8.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -81.8 -12.81 58.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -69.39 -45.27 69.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.874 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 6.9 p -119.3 -42.0 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.23 23.93 4.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.481 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -91.77 137.41 32.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.798 0.332 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.24 150.11 5.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -135.0 161.99 33.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -62.01 -73.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -113.44 -176.25 2.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.838 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -70.0 -36.94 75.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 -37.99 68.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -68.29 -45.46 72.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.841 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.481 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.8 tp -67.41 -32.46 73.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.0 -53.9 36.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.112 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 22.4 mmt-85 -64.22 -26.26 68.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.583 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.9 t60 -77.37 -23.94 50.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.841 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -72.91 -10.32 59.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.23 25.16 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.889 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.3 tt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.806 0.252 . . . . 0.0 112.364 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.723 ' HB3' HD22 ' A' ' 472' ' ' LEU . 42.4 m-85 -76.16 138.48 40.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.936 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -119.27 129.89 55.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.31 119.29 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.917 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -79.46 -7.63 58.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.849 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.4 -49.09 17.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.937 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.1 p -117.2 -40.35 3.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.79 21.41 4.63 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.46 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -88.46 128.09 35.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.815 0.34 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.81 146.85 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.129 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -127.02 -176.42 3.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -94.03 -67.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -105.58 150.99 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -52.0 -30.05 23.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.9 t -58.28 -49.89 75.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.859 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -57.41 -44.09 84.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.723 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.0 tp -67.36 -32.39 73.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.898 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.04 -54.63 27.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.064 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.57 -26.05 68.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.614 ' O ' HG22 ' A' ' 478' ' ' ILE . 83.0 t60 -79.43 -18.73 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.847 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -79.49 -16.77 55.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 12.7 mt -95.67 25.96 4.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.614 HG22 ' O ' ' A' ' 475' ' ' HIS . 9.8 tt . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.14 0 CA-C-O 120.811 0.254 . . . . 0.0 112.31 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' TYR . . . . . 0.47 ' HB3' HD22 ' A' ' 472' ' ' LEU . 77.2 m-85 -66.28 141.87 57.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.905 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' LYS . . . . . 0.466 ' HG3' HG22 ' A' ' 465' ' ' VAL . 77.2 tttt -127.79 109.73 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.897 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.6 t -53.17 119.37 4.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -81.1 -16.39 53.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.837 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.68 -47.19 82.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 7.5 p -118.07 -41.74 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.88 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.61 27.04 2.92 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.2 mttm -95.75 132.27 41.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.823 0.344 . . . . 0.0 110.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 ' HG3' ' A' ' 458' ' ' LYS . 46.5 t -94.57 147.05 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -129.66 139.39 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.849 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -52.09 -44.68 64.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.877 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -135.59 170.03 16.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.867 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -67.58 -36.81 81.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.926 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 4.9 p -52.11 -34.95 46.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.865 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -77.63 -34.86 53.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.5 tp -73.03 -28.68 62.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.37 -56.96 15.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.108 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -60.52 -26.05 66.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' HIS . . . . . 0.594 ' O ' HG22 ' A' ' 478' ' ' ILE . 70.7 t60 -79.73 -24.02 41.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -71.8 -9.75 58.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 14.1 mt -98.82 24.64 7.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.17 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 60.5 m -60.49 140.68 57.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.849 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 94.0 p -115.04 165.81 12.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.892 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 111.18 108.64 3.06 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.511 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 4.2 p -113.04 150.15 32.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.842 0.353 . . . . 0.0 110.853 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.9 p -96.58 54.31 1.34 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.853 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 76.1 -132.47 12.86 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 9.9 t -65.1 -25.82 67.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.808 0.337 . . . . 0.0 111.149 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 60.06 -156.96 28.15 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.502 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -168.96 159.28 9.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.875 0.369 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -148.25 73.78 10.91 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.559 0.695 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 129.39 17.55 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.74 2.293 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.431 ' HB3' HD22 ' A' ' 472' ' ' LEU . 49.3 m-85 -76.01 146.46 39.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.949 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 37.4 tttp -126.71 119.57 27.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.907 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 14.1 t -62.83 118.92 8.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.923 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.2 t-160 -80.02 -12.19 59.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 45.8 mm-40 -69.14 -49.26 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.3 p -117.13 -40.4 3.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 117.12 21.76 4.4 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.455 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 26.5 mttp -89.78 130.98 35.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.84 0.352 . . . . 0.0 110.918 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -92.58 149.91 4.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.114 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -135.09 150.34 50.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.881 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -62.14 -65.79 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 -101.89 -179.83 4.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.907 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -78.71 -42.16 29.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.6 m -52.09 -43.64 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -57.42 -35.82 70.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.431 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.8 tp -76.65 -33.99 58.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.899 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.55 -55.17 37.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.105 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.19 -32.47 72.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.875 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.1 t60 -67.76 -38.73 83.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.869 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -55.18 -26.48 39.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.883 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.4 mt -54.2 -36.4 63.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.899 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt -63.42 -25.67 38.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.098 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -96.83 -67.16 0.86 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 3.6 t -104.25 152.69 21.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.126 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -140.91 82.09 0.24 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -115.83 99.94 7.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.886 0.374 . . . . 0.0 110.895 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -116.46 71.82 4.95 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.589 0.709 . . . . 0.0 110.902 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -46.59 1.17 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.714 2.276 . . . . 0.0 112.323 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 2.0 t -69.3 105.39 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.842 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 134.41 75.19 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.523 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 151.89 68.94 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 14.9 m -105.27 -59.39 1.76 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.858 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 10.0 p -62.24 -50.39 71.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.874 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 119.126 -0.819 . . . . 0.0 112.461 -179.977 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 8.7 t -114.44 61.63 0.67 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.869 0.366 . . . . 0.0 110.887 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.2 m -103.0 160.84 14.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.86 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -53.07 -38.18 55.43 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.485 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.7 t -147.64 157.83 43.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.835 0.35 . . . . 0.0 110.889 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 27.7 t -115.31 -56.71 2.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.842 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 147.99 -104.09 0.28 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.489 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 5.6 p -87.03 -52.54 5.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.818 0.342 . . . . 0.0 111.125 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 83.33 62.46 1.8 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.463 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -119.86 76.82 1.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.961 0.41 . . . . 0.0 110.893 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -127.85 71.4 78.29 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.563 0.697 . . . . 0.0 110.917 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 111.35 2.78 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.663 2.242 . . . . 0.0 112.358 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -70.15 139.36 52.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.898 -179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 59.2 tttt -118.4 109.15 15.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.879 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -51.95 120.78 5.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.872 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -86.01 4.72 36.6 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.908 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -90.05 -43.75 10.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.907 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 14.6 p -122.8 -35.55 3.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.853 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.93 24.36 5.22 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.505 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 4.3 mtpm? -91.99 127.29 37.4 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.814 0.34 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.9 t -92.07 149.76 4.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -139.62 156.99 46.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.903 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.41 -74.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.878 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 44.1 mtt85 -106.67 155.18 19.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -51.93 -33.35 36.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -53.33 -35.75 60.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.841 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -73.02 -32.07 64.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.853 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 8.8 tp -78.07 -33.09 51.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.934 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.76 -53.56 53.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.102 179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.0 -27.31 66.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.868 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 73.7 t60 -66.47 -41.92 88.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.881 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 29.8 mm-40 -56.82 -24.48 51.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.923 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 79.5 mt -55.94 -26.64 48.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.2 tt -76.6 -25.55 16.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.149 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -90.03 -31.39 17.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.877 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 7.8 t -159.37 145.53 16.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.13 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -130.62 125.26 4.51 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.554 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -103.13 49.18 0.84 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 0.0 110.888 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.0 tttt -167.62 71.65 0.94 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.577 0.704 . . . . 0.0 110.924 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 179.31 3.78 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.684 2.256 . . . . 0.0 112.387 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 21.4 p -84.6 -177.8 6.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.889 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -137.6 167.59 24.74 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.523 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 -43.48 2.58 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.274 . . . . 0.0 112.308 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 6.2 t -115.62 138.55 50.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.887 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 7.4 p 53.37 28.84 7.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.886 -179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.099 -0.834 . . . . 0.0 112.495 -179.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 N-CA-C 112.435 -0.266 . . . . 0.0 112.435 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.6 m -103.69 136.64 43.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.903 0.382 . . . . 0.0 110.835 -179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 54.6 p -71.27 -34.49 70.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.849 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -94.71 150.23 19.66 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.468 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 87.4 p -141.53 156.5 45.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.879 0.371 . . . . 0.0 110.816 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 27.7 p -98.56 98.76 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.904 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.13 129.41 5.41 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.479 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.64 107.69 19.34 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.831 0.348 . . . . 0.0 111.13 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -171.35 -115.37 0.35 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.499 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -114.05 109.18 18.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 110.858 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.04 73.63 0.54 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.572 0.701 . . . . 0.0 110.89 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 161.2 46.83 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.695 2.263 . . . . 0.0 112.312 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.421 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.0 m-85 -84.52 119.5 25.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.427 ' HG3' HG22 ' A' ' 465' ' ' VAL . 18.2 tttp -100.41 113.53 26.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.881 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -57.37 121.13 9.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.904 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -85.5 4.03 37.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.82 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 52.1 mm-40 -90.06 -44.68 9.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.909 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.9 p -122.43 -35.12 3.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.866 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.45 22.63 5.73 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.483 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 16.2 mttm -90.92 126.07 35.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.841 0.353 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.427 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.3 t -91.5 147.87 4.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.182 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -137.09 135.07 37.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 91.2 mtt-85 -53.2 -62.93 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -96.53 170.81 8.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -79.08 -30.39 43.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.884 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.12 -43.36 87.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.839 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -59.02 -27.08 65.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.877 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.421 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -83.53 -36.71 23.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.851 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.52 -52.77 60.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.077 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 42.9 mtt85 -70.73 -26.63 63.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.866 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.8 t60 -68.66 -39.79 80.49 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.853 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 18.0 mm-40 -55.75 -25.86 42.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.916 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.9 mt -54.52 -35.02 62.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.942 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.656 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.9 tt -65.63 -25.4 36.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.13 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 94.3 m-70 -95.63 -63.46 1.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.859 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 40.7 p -52.49 114.88 1.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -73.76 109.21 2.73 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.454 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -160.17 154.23 23.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.9 0.381 . . . . 0.0 110.889 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.2 ttpp -117.81 72.85 8.55 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.568 0.699 . . . . 0.0 110.892 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 82.94 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.71 2.273 . . . . 0.0 112.333 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.9 t -80.26 147.78 31.05 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.86 -179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -96.26 -174.46 35.87 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.539 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 -34.29 14.75 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.609 2.206 . . . . 0.0 112.357 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 5.0 p -112.25 36.04 3.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.856 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.3 t 59.21 44.53 15.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.901 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.494 -179.982 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.464 -0.254 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 8.0 m -149.96 166.96 28.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.912 0.386 . . . . 0.0 110.836 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 12.9 p -163.45 146.69 10.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.888 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -101.41 65.74 0.48 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.493 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 34.7 m -85.18 -30.92 23.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.924 0.393 . . . . 0.0 110.893 -179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 29.4 t -74.53 137.04 42.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 93.94 56.37 1.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.466 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 71.7 p -58.95 147.41 34.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.125 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 145.46 -57.38 0.52 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.48 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -110.1 100.32 9.25 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.896 0.379 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -159.05 68.4 3.29 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.558 0.694 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 134.68 28.56 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.704 2.269 . . . . 0.0 112.329 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.605 ' HB3' HD22 ' A' ' 472' ' ' LEU . 34.7 m-85 -86.33 144.72 27.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 13.3 tttm -121.87 126.15 48.07 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.891 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.1 t -69.94 120.95 16.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -84.09 1.85 42.11 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.817 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -89.38 -43.42 10.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.874 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.5 p -122.64 -35.8 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.903 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.72 23.18 6.02 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.511 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttm -89.14 127.83 35.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.815 0.34 . . . . 0.0 110.936 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 29.1 t -93.86 146.16 6.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -131.76 156.18 46.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 22.7 ttm-85 -72.49 -60.9 2.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.829 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.1 mmt-85 -96.92 -177.54 3.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -88.02 -38.46 15.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.87 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.5 p -55.79 -44.16 77.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -55.48 -37.73 68.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 457' ' ' TYR . 16.9 tp -74.82 -38.33 62.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.896 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.17 -53.69 49.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.09 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.427 ' HD3' HD11 ' A' ' 477' ' ' LEU . 20.2 mmt180 -65.19 -28.04 69.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.888 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.646 ' O ' HG22 ' A' ' 478' ' ' ILE . 80.4 t60 -69.64 -41.23 75.88 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.826 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -55.79 -25.92 43.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.92 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.427 HD11 ' HD3' ' A' ' 474' ' ' ARG . 64.7 mt -54.58 -33.63 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.921 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.6 tt -66.66 -26.12 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.179 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -93.26 -59.65 1.98 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.845 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 81.8 p -55.09 122.53 11.18 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.176 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -145.29 -150.65 5.25 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.467 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -117.99 118.59 32.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 110.904 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.9 mmtp 55.58 71.82 1.17 Allowed Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.594 0.711 . . . . 0.0 110.876 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -18.98 36.83 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.749 2.3 . . . . 0.0 112.347 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 23.0 t -123.87 35.68 4.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.879 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 65.82 -179.81 10.04 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.489 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.75 143.25 50.3 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.715 2.277 . . . . 0.0 112.387 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 34.5 t -143.72 159.99 41.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.897 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.4 t -96.03 -71.13 0.69 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.865 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 CA-C-O 119.133 -0.815 . . . . 0.0 112.494 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.481 -0.247 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 62.2 m -115.7 -179.71 3.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.872 0.367 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.7 t -81.21 165.99 21.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.8 -179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -150.63 138.85 6.89 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.523 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.3 t -118.75 59.6 0.82 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.927 0.394 . . . . 0.0 110.885 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.0 t -103.04 42.23 1.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.827 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -158.81 125.79 1.57 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.492 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 4.2 p -134.91 105.96 6.64 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.844 0.354 . . . . 0.0 111.127 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -152.72 168.72 31.73 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -109.63 -28.15 9.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.906 0.384 . . . . 0.0 110.892 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 13.8 ptpt -167.32 72.85 1.0 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.62 0.724 . . . . 0.0 110.899 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 134.09 27.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.678 2.252 . . . . 0.0 112.371 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.585 ' HB3' HD22 ' A' ' 472' ' ' LEU . 31.5 m-85 -82.23 138.89 34.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.926 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 5.4 tmtt? -117.79 130.28 56.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.0 t -74.69 121.14 21.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.84 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -82.7 0.78 41.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.88 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -88.84 -41.67 12.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.871 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 12.1 p -125.09 -38.22 2.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.832 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.54 23.09 5.81 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.459 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -89.85 113.89 25.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.811 0.339 . . . . 0.0 110.891 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.6 t -85.33 144.83 8.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.099 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -125.77 171.88 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.863 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -84.42 -52.7 5.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.888 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -110.01 177.45 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.835 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -80.0 -42.75 23.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.8 t -52.1 -43.35 63.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -57.37 -37.16 72.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.887 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.0 tp -77.41 -35.42 54.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.991 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.87 -52.62 56.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.134 179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 17.3 mmt180 -68.69 -26.15 65.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.9 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.658 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.8 t60 -69.79 -39.07 76.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.798 180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -54.92 -26.67 37.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.944 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.7 mt -54.33 -40.7 68.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.911 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.658 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt -57.88 -24.65 23.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.091 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 89.9 m-70 -100.19 -69.57 0.77 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.89 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 7.8 t -94.78 155.73 16.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.153 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -150.4 55.84 0.47 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.458 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -105.09 69.6 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.958 0.409 . . . . 0.0 110.923 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -145.98 72.85 13.56 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.568 0.699 . . . . 0.0 110.937 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.67 -42.69 3.28 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.727 2.285 . . . . 0.0 112.348 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 13.4 m -76.83 130.96 38.36 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.823 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -59.66 -174.0 0.75 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.471 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 149.01 66.13 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.677 2.252 . . . . 0.0 112.366 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.1 p -107.0 165.36 11.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 9.6 t -105.18 145.5 30.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.862 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 CA-C-O 119.148 -0.807 . . . . 0.0 112.475 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.497 -0.241 . . . . 0.0 112.497 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 82.7 p -74.48 130.12 39.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.84 0.352 . . . . 0.0 110.902 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 41.3 t -118.88 56.44 0.9 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.843 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 179.15 176.74 47.16 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.527 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 4.1 t -151.85 155.58 38.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.85 0.357 . . . . 0.0 110.85 -179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 35.7 m -137.25 129.18 29.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.85 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -86.08 -60.36 1.76 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.468 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 10.4 t -168.15 155.25 7.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.124 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 160.26 -177.28 36.77 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.47 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -122.39 116.75 24.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.934 0.397 . . . . 0.0 110.885 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 8.4 tmtt? -151.32 71.32 8.4 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.562 0.696 . . . . 0.0 110.875 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 135.76 31.28 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.7 2.267 . . . . 0.0 112.342 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.587 ' HB3' HD22 ' A' ' 472' ' ' LEU . 39.3 m-85 -79.31 141.97 36.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.896 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.442 ' HG3' HG22 ' A' ' 465' ' ' VAL . 69.4 tttt -124.47 108.93 12.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 3.7 t -51.99 118.19 3.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.874 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 10.0 t-160 -84.26 0.85 47.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.852 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -90.05 -40.4 12.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.879 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 19.7 p -122.93 -35.61 3.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 108.81 25.19 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.526 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 30.1 mttp -92.07 126.69 37.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.367 . . . . 0.0 110.876 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.442 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.7 t -91.47 148.68 4.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.085 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -135.21 162.56 32.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.912 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -78.77 -63.61 1.37 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.889 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 40.4 mmm-85 -99.33 167.13 10.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -69.74 -34.06 73.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.1 m -61.07 -46.94 88.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -52.36 -32.11 36.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.587 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -82.07 -34.9 29.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.961 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.79 -53.96 51.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.061 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -62.78 -27.26 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.82 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.637 ' O ' HG22 ' A' ' 478' ' ' ILE . 69.8 t60 -72.61 -38.05 67.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -56.25 -25.31 47.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.911 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 55.2 mt -55.32 -28.94 57.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.637 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.9 tt -72.13 -26.57 25.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.122 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -91.02 -45.81 8.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.875 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 10.0 t -122.78 150.64 42.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.118 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.61 -137.41 7.76 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.468 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -148.28 117.49 6.87 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.964 0.411 . . . . 0.0 110.862 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 13.3 tptp 53.99 71.69 1.3 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.559 0.695 . . . . 0.0 110.91 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 83.31 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.33 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 41.2 t -73.23 -48.43 35.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.837 -179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 143.45 170.38 13.14 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.468 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 165.0 32.47 Favored 'Trans proline' 0 C--N 1.341 0.138 0 C-N-CA 122.662 2.242 . . . . 0.0 112.346 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.5 m -93.56 56.42 2.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.874 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 2.1 m -71.51 112.01 7.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.855 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 CA-C-O 119.127 -0.818 . . . . 0.0 112.493 -179.975 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.5 t -93.98 95.06 8.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 110.82 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 84.1 p -155.99 127.31 7.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 153.62 152.7 6.13 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.512 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 t -164.27 125.87 2.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.87 0.367 . . . . 0.0 110.856 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.1 p -80.87 114.91 20.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.875 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 146.87 155.67 6.63 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.529 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 8.7 t -151.56 152.6 33.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.874 0.368 . . . . 0.0 111.144 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -108.32 -58.92 0.55 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.467 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -82.81 -175.9 6.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.943 0.402 . . . . 0.0 110.877 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -174.03 68.51 0.32 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.635 0.731 . . . . 0.0 110.922 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 140.35 42.53 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.7 2.266 . . . . 0.0 112.332 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 17.4 m-85 -75.79 141.93 42.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.875 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 56.0 tttt -120.8 109.84 15.64 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.897 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.3 t -51.97 118.45 3.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.843 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 -84.15 2.41 39.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.839 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -89.96 -41.12 11.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.891 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.6 p -123.99 -36.41 2.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.862 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.79 23.62 5.54 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.503 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 23.6 mttm -90.87 129.18 36.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 0.0 110.854 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.12 149.99 3.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.113 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -141.36 148.78 40.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.912 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 42.3 mmm-85 -55.07 -72.92 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.858 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -100.85 -175.14 2.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.86 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -86.36 -32.83 20.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.851 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.38 -33.87 55.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -74.09 -37.53 64.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.874 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 5.8 tp -73.1 -35.34 66.57 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.78 -49.69 62.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.093 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 14.5 mmt180 -74.2 -25.85 59.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.849 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.694 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.7 t60 -70.95 -22.29 62.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.882 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -74.26 -20.5 60.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.923 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 43.5 mt -66.29 -38.97 89.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.933 -179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.694 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.7 tt -56.72 -24.16 18.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.14 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -87.21 -25.95 23.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 61.2 p -100.13 166.69 10.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.101 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -139.16 100.65 0.29 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.506 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -60.76 110.0 1.2 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.9 0.381 . . . . 0.0 110.856 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 14.3 tptm -161.37 72.89 2.57 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.603 0.716 . . . . 0.0 110.918 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 -42.67 3.17 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.672 2.248 . . . . 0.0 112.333 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 2.9 p -55.91 170.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.855 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -176.42 -75.09 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.475 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 97.65 0.65 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.674 2.249 . . . . 0.0 112.397 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 9.0 p -54.43 162.41 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.836 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 82.5 p -107.77 34.46 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.785 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 CA-C-O 119.132 -0.815 . . . . 0.0 112.474 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.46 -0.256 . . . . 0.0 112.46 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 90.1 p -96.31 35.38 1.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.907 0.384 . . . . 0.0 110.881 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 20.2 p -161.27 129.6 4.39 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.89 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -72.52 -147.81 0.78 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.496 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 27.2 p -99.85 87.79 3.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.862 0.363 . . . . 0.0 110.863 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 11.1 t -103.38 -68.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.865 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 141.77 141.83 3.99 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.483 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.3 m -79.5 -28.7 41.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.861 0.362 . . . . 0.0 111.182 -179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -82.09 -62.28 1.92 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.493 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 56.07 26.3 9.94 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.891 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.2 160.7 0.12 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.592 0.71 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.83 148.01 63.67 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.71 2.273 . . . . 0.0 112.311 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.419 ' HB3' HD22 ' A' ' 472' ' ' LEU . 43.1 m-85 -70.51 136.33 49.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.941 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.461 ' HG3' HG22 ' A' ' 465' ' ' VAL . 19.4 tttp -115.53 111.28 20.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.863 179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -54.02 120.88 6.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -85.73 4.3 37.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.869 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -89.99 -46.44 8.51 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.899 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.88 -34.17 3.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.862 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.78 23.61 5.55 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.483 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -90.48 126.9 36.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.829 0.347 . . . . 0.0 110.873 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.461 HG22 ' HG3' ' A' ' 458' ' ' LYS . 23.8 t -92.3 149.34 4.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.138 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -140.97 139.98 34.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.851 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 43.5 ttt-85 -52.37 -66.8 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 46.1 mtp85 -103.01 169.39 8.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.897 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -72.77 -32.72 65.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 88.7 p -52.09 -37.96 55.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.837 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -70.1 -34.75 73.52 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.854 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.3 tp -75.98 -31.23 58.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.946 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -58.12 -56.67 19.07 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.087 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.58 -26.78 67.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.885 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.654 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.3 t60 -67.22 -40.15 86.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.8 mm-40 -55.91 -25.66 43.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.924 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 68.9 mt -54.76 -33.42 61.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.949 179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.7 tt -67.46 -25.84 34.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.177 179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -92.65 -57.32 2.71 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.879 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 8.9 t -117.7 129.95 56.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.126 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -153.49 -111.07 0.43 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.492 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -160.23 140.55 11.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.908 0.385 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp 53.17 73.29 0.96 Allowed Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.62 0.724 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 121.36 8.05 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.742 2.294 . . . . 0.0 112.343 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 12.4 p -91.84 114.57 27.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.842 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -158.19 173.62 35.37 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.518 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -29.42 23.75 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.711 2.274 . . . . 0.0 112.326 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 80.6 p -59.95 168.4 1.85 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.834 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 21.0 m -128.41 148.43 50.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.825 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 CA-C-O 119.114 -0.826 . . . . 0.0 112.496 -179.977 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 112.522 -0.231 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 15.0 m -82.39 172.18 13.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.865 0.364 . . . . 0.0 110.869 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 97.2 p -108.81 137.43 46.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.858 -179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -95.86 83.92 0.86 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.53 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 79.5 p -127.48 125.41 40.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.851 0.358 . . . . 0.0 110.893 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.0 p -76.32 89.66 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.832 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 71.71 -156.38 52.63 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.462 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.8 m -110.67 -51.34 2.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.831 0.348 . . . . 0.0 111.167 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 83.37 -92.79 1.68 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -103.54 143.7 32.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 110.876 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -125.82 69.63 64.89 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.602 0.715 . . . . 0.0 110.919 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 122.5 9.17 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.657 2.238 . . . . 0.0 112.345 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -71.37 145.92 49.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.863 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.434 ' HG3' HG22 ' A' ' 465' ' ' VAL . 74.9 tttt -126.46 122.55 35.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.4 t -62.66 120.8 11.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.871 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -85.38 3.97 37.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.844 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -90.04 -45.78 8.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.942 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.3 p -120.52 -33.26 3.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.926 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 107.97 27.26 5.19 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.484 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 33.3 mttp -94.41 126.33 39.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.811 0.338 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.434 HG22 ' HG3' ' A' ' 458' ' ' LYS . 43.2 t -93.2 147.33 5.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.151 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -132.89 173.17 11.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.891 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -75.64 -73.26 0.27 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.846 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.53 160.59 15.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.889 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -52.0 -36.48 50.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.863 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.0 m -54.3 -49.95 68.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -56.24 -29.75 61.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.825 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . . . . . . . . . 10.4 tp -81.88 -36.48 28.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.909 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -54.87 -51.87 64.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -65.4 -27.23 68.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.847 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.64 ' O ' HG22 ' A' ' 478' ' ' ILE . 81.1 t60 -72.35 -40.14 67.59 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -56.01 -25.42 44.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.9 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.0 mt -55.33 -28.84 56.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.64 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.0 tt -72.16 -26.66 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -92.75 -54.32 3.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.872 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 66.8 p -51.78 105.45 0.11 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.116 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.65 -34.47 6.93 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.502 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -139.67 171.94 13.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.894 0.378 . . . . 0.0 110.905 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 18.8 mttm -127.5 160.7 59.08 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.545 0.688 . . . . 0.0 110.919 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -45.96 1.39 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.681 2.254 . . . . 0.0 112.361 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 7.3 m -68.31 157.77 34.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.856 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 156.25 -71.58 0.26 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 84.16 0.67 Allowed 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.658 2.238 . . . . 0.0 112.319 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 24.4 p -96.79 146.07 25.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.823 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 4.0 m -166.24 155.98 11.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.869 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 CA-C-O 119.104 -0.831 . . . . 0.0 112.518 -179.99 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.458 -0.257 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 4.4 p 55.41 28.29 11.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 0.0 110.879 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 5.3 m -112.4 79.62 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.831 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -105.66 102.18 1.95 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.495 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 12.8 m -100.1 163.64 12.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.866 0.365 . . . . 0.0 110.886 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 85.6 p -140.9 154.82 46.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.837 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 151.56 91.25 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.537 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.02 130.6 34.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.833 0.349 . . . . 0.0 111.151 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 93.13 52.5 2.04 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.446 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 13.7 tp10 -151.76 139.09 19.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.945 0.403 . . . . 0.0 110.886 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt 63.26 160.63 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.538 0.685 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 133.42 25.45 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.699 2.266 . . . . 0.0 112.362 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.435 ' HB3' HD22 ' A' ' 472' ' ' LEU . 51.6 m-85 -77.83 142.01 38.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.924 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -121.4 126.38 49.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.919 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 17.9 t -66.67 115.2 6.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.911 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -77.62 -5.93 52.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.83 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -78.0 -54.77 5.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.7 p -111.2 -36.7 5.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.873 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.34 27.22 3.99 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.515 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.3 mtpp -95.45 127.0 41.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.7 t -92.6 150.02 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.109 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -134.48 -177.18 4.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.857 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 47.5 mtt85 -90.17 -73.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.58 164.34 12.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.832 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -65.12 -31.0 71.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.883 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 20.9 t -61.56 -46.03 91.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 -179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -55.89 -34.25 65.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.435 HD22 ' HB3' ' A' ' 457' ' ' TYR . 10.8 tp -80.36 -40.3 26.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.956 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.77 -38.57 56.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -80.98 -25.95 36.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.702 ' O ' HG22 ' A' ' 478' ' ' ILE . 74.1 t60 -70.56 -28.89 65.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.839 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -65.73 -24.83 67.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.866 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.1 mt -55.41 -44.02 75.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.939 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.702 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt -57.97 -22.65 19.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.109 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -90.38 -48.48 7.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.842 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 10.2 t -104.37 45.99 0.94 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.166 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -135.43 -172.31 12.66 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.469 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 50.6 tp10 -112.55 -42.82 3.58 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.894 0.378 . . . . 0.0 110.881 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 5.6 tppt? 63.24 73.06 0.52 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.541 0.686 . . . . 0.0 110.903 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 117.75 5.27 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.682 2.255 . . . . 0.0 112.35 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 97.1 p -122.4 178.3 5.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.862 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -89.57 167.12 33.5 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.5 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 -48.23 0.76 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.675 2.25 . . . . 0.0 112.34 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 16.6 t -126.76 98.82 5.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.855 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.4 p -167.24 157.43 11.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 CA-C-O 119.114 -0.826 . . . . 0.0 112.53 179.992 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 11.5 t -142.88 126.72 17.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.851 0.357 . . . . 0.0 110.881 -179.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 3.0 t -84.73 62.89 7.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 91.47 -142.87 16.28 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.477 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 3.0 t 54.1 47.55 23.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 0.0 110.856 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.3 m -112.54 -65.38 1.19 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.865 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 175.92 150.2 7.92 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.504 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 2.0 t -114.43 72.0 0.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.872 0.367 . . . . 0.0 111.145 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 96.44 -176.69 32.85 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.51 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 -69.48 -31.61 70.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.96 0.41 . . . . 0.0 110.888 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 30.4 ttpt 53.46 68.95 2.51 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.55 0.69 . . . . 0.0 110.866 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 127.54 14.75 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.699 2.266 . . . . 0.0 112.347 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.467 ' HB3' HD22 ' A' ' 472' ' ' LEU . 65.4 m-85 -76.55 137.97 39.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.927 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 8.7 tttm -120.63 119.77 33.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.928 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.3 t -61.37 120.7 10.96 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.903 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 70.9 m-70 -85.04 3.62 37.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.882 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -89.98 -44.03 10.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.2 p -122.7 -35.89 2.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.903 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 24.37 5.54 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.48 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 29.3 mttp -90.92 127.0 36.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.897 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 39.0 t -92.47 147.48 5.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.075 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -131.7 170.92 14.12 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.863 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -81.85 -65.98 0.94 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 45.3 mtp85 -106.73 156.47 18.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.841 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -51.92 -42.17 62.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 33.8 t -52.41 -46.8 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -55.05 -31.12 60.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.81 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 457' ' ' TYR . 11.5 tp -82.89 -31.92 27.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.956 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.14 -51.66 69.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.067 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 32.9 mmt-85 -65.3 -28.72 69.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.863 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.648 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.5 t60 -69.53 -39.28 77.59 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.865 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -56.77 -24.64 51.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.919 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 53.6 mt -55.89 -26.04 45.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.88 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.648 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.4 tt -76.7 -25.94 16.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -92.23 -33.71 14.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.85 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 69.1 p -79.42 90.91 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -88.03 -133.5 4.27 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.537 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -79.37 151.98 30.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.933 0.397 . . . . 0.0 110.876 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.51 160.67 30.69 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.615 0.722 . . . . 0.0 110.871 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 102.09 0.99 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.729 2.286 . . . . 0.0 112.313 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.5 m -141.98 142.96 32.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.874 -179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -141.31 72.56 0.4 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.513 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -26.03 28.07 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.673 2.249 . . . . 0.0 112.373 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -59.11 105.91 0.37 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.842 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 12.9 t -113.9 -31.61 6.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.876 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 CA-C-O 119.104 -0.831 . . . . 0.0 112.459 179.955 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 77.3 p -158.39 121.42 3.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 110.842 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 7.6 t -163.77 154.47 15.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.852 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 176.59 -165.48 35.78 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.475 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.1 m -132.1 118.73 20.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.844 0.354 . . . . 0.0 110.875 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 40.5 m -152.19 124.19 8.05 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 99.25 89.04 1.98 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.478 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 3.2 t -151.6 149.19 28.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 111.145 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 151.26 157.24 7.77 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.462 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -78.28 136.17 37.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.869 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -117.7 160.64 37.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.577 0.703 . . . . 0.0 110.903 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 119.79 6.68 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.707 2.272 . . . . 0.0 112.332 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.56 ' HB3' HD22 ' A' ' 472' ' ' LEU . 17.5 m-85 -79.61 147.05 32.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.918 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.451 ' HG3' HG22 ' A' ' 465' ' ' VAL . 21.5 tttp -119.46 110.44 16.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.889 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 4.8 t -52.87 118.13 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -83.98 2.23 39.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.92 -42.42 11.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.922 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 20.1 p -122.56 -35.31 3.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.861 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.18 22.39 6.54 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.486 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -91.2 129.6 37.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.451 HG22 ' HG3' ' A' ' 458' ' ' LYS . 26.1 t -96.41 148.87 5.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.106 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -130.34 -177.36 4.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -82.88 -58.48 2.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.874 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -126.58 169.72 12.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.836 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -53.79 -45.8 70.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.896 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 60.6 m -52.36 -52.29 54.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 20.8 m170 -55.01 -27.89 47.84 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.871 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.7 tp -84.88 -31.11 23.91 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.879 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.22 -54.9 41.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.094 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -55.78 -27.37 50.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.874 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.633 ' O ' HG22 ' A' ' 478' ' ' ILE . 75.4 t60 -78.47 -36.4 45.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.839 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -55.7 -25.9 42.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.916 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 58.2 mt -54.78 -32.1 59.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.913 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 475' ' ' HIS . 11.8 tt -68.13 -26.61 34.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.086 179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -94.05 -62.43 1.35 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.83 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 14.2 t -112.81 147.16 37.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.126 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 179.47 -147.88 7.83 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.444 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -133.25 152.1 51.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.907 0.384 . . . . 0.0 110.867 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 18.1 pttm -128.97 70.89 81.76 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.572 0.701 . . . . 0.0 110.89 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 110.51 2.57 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.665 2.243 . . . . 0.0 112.385 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 3.8 m 56.86 32.92 22.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.843 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -104.23 -168.12 24.88 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.517 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 140.26 42.2 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.71 2.274 . . . . 0.0 112.319 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 30.9 t -110.16 -42.7 4.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.825 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 9.3 p 53.51 33.98 17.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.874 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 CA-C-O 119.132 -0.816 . . . . 0.0 112.493 179.994 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.452 -0.259 . . . . 0.0 112.452 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 42.6 m -105.94 136.45 45.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.86 0.362 . . . . 0.0 110.884 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.97 105.3 5.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.885 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -156.31 164.61 32.53 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.481 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.1 m -106.95 -64.84 1.14 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 110.842 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 61.3 m -108.18 101.87 11.06 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.863 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -146.63 -83.46 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.498 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 4.3 m -110.22 115.36 29.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.809 0.338 . . . . 0.0 111.179 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 106.6 143.19 11.15 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.504 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 79.6 mt-10 -83.72 161.08 21.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.918 0.39 . . . . 0.0 110.94 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 31.5 mmtm -137.23 69.43 55.62 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.619 0.723 . . . . 0.0 110.925 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 125.78 12.55 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.643 2.228 . . . . 0.0 112.348 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.437 ' HB3' HD22 ' A' ' 472' ' ' LEU . 24.1 m-85 -78.22 146.86 34.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.957 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 50.3 tttt -125.54 122.04 35.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.93 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.4 t -62.92 119.01 8.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 -83.82 2.07 40.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -90.06 -42.87 10.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 23.0 p -121.99 -34.9 3.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 109.52 23.49 6.26 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.523 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 20.1 mttp -90.73 127.14 36.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -91.96 149.82 4.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.127 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -135.38 162.2 33.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 44.9 ttm-85 -70.56 -56.71 5.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.853 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -116.47 179.79 3.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.82 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -81.8 -26.53 34.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 62.3 p -60.89 -38.79 86.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.9 -179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -69.58 -39.12 77.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.876 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.437 HD22 ' HB3' ' A' ' 457' ' ' TYR . 6.4 tp -72.15 -37.69 69.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -51.76 -45.97 63.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 7.2 mmt180 -77.58 -26.11 50.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.859 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.664 ' O ' HG22 ' A' ' 478' ' ' ILE . 76.9 t60 -68.32 -26.9 65.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.885 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -67.59 -25.92 66.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.916 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 64.8 mt -54.19 -43.31 70.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.9 tt -56.73 -24.63 19.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.129 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -89.91 -26.28 20.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 69.9 p -95.08 124.81 39.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.121 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -158.4 -67.5 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.486 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -133.72 139.84 46.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.885 0.374 . . . . 0.0 110.872 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 2.6 mmtp -139.17 160.66 61.43 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.579 0.704 . . . . 0.0 110.897 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 96.47 0.6 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.67 2.247 . . . . 0.0 112.311 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 6.0 p -113.77 -57.21 2.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.859 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -93.76 -74.51 1.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.494 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 98.55 0.69 Allowed 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.694 2.262 . . . . 0.0 112.365 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 3.4 t -94.82 -59.4 1.92 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.82 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 5.0 p 55.45 27.63 10.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.925 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 CA-C-O 119.116 -0.824 . . . . 0.0 112.433 -179.933 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 2.1 p -138.72 138.87 38.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.887 0.375 . . . . 0.0 110.811 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 23.1 t -61.91 -41.99 98.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.844 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 81.71 -95.86 1.74 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.455 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 5.6 p -141.34 152.14 44.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.875 0.369 . . . . 0.0 110.862 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 59.8 m -143.13 122.11 12.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.866 -179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -96.53 26.72 20.53 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.488 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 21.0 p -95.6 168.6 10.59 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.849 0.357 . . . . 0.0 111.146 -179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 161.61 -115.92 0.68 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -166.34 139.78 4.07 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.873 0.368 . . . . 0.0 110.888 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -127.99 160.67 60.24 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.596 0.712 . . . . 0.0 110.901 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 138.53 38.11 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.679 2.253 . . . . 0.0 112.352 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.54 ' HB3' HD22 ' A' ' 472' ' ' LEU . 28.9 m-85 -77.59 143.53 38.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.907 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 9.8 tttm -122.01 120.13 33.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.0 t -63.2 119.06 8.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -83.28 -0.1 48.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.87 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -87.42 -42.88 12.5 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.868 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 18.5 p -122.58 -36.19 2.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.841 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 111.4 21.72 6.42 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.494 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.7 mttm -88.51 127.05 35.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.81 0.338 . . . . 0.0 110.925 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 25.3 t -90.96 148.71 4.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.144 179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -136.46 143.03 43.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.873 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 39.5 ttp180 -56.56 -64.24 0.93 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.882 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -103.47 -177.1 3.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.933 -179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -85.54 -32.46 22.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.869 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -54.67 -41.69 70.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.831 -179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -64.43 -39.03 93.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.54 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.2 tp -71.75 -39.0 70.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -53.41 -48.71 68.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.115 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 16.7 mtm180 -72.75 -26.37 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.87 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.651 ' O ' HG22 ' A' ' 478' ' ' ILE . 79.5 t60 -68.45 -37.65 80.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.927 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -56.09 -26.0 47.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.941 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 74.6 mt -53.62 -43.91 69.05 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.897 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.651 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.1 tt -57.54 -24.41 22.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.174 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -96.62 -69.98 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 8.7 t -105.59 143.89 33.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.112 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -169.29 147.44 11.07 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.517 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -73.74 143.42 46.1 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.946 0.403 . . . . 0.0 110.86 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 11.1 mptt 52.83 72.25 1.22 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.9 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 113.24 3.31 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.666 2.244 . . . . 0.0 112.354 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 7.2 t -82.37 122.75 28.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.861 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 148.44 71.27 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.508 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 -43.46 2.66 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.681 2.254 . . . . 0.0 112.334 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.4 m -75.18 88.48 2.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.871 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 4.3 m -114.26 127.77 56.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.829 -179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 CA-C-O 119.154 -0.803 . . . . 0.0 112.509 -179.958 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 1.7 p -145.2 133.38 21.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 110.859 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 26.6 t -171.8 152.08 2.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.855 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 161.5 103.36 0.18 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.491 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.61 172.07 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.871 -179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 67.4 p -155.41 132.84 11.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.93 20.54 4.04 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.5 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 32.5 p -69.8 140.91 53.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.853 0.359 . . . . 0.0 111.147 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -140.48 90.05 0.19 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.459 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -115.22 31.04 6.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.875 0.369 . . . . 0.0 110.823 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.22 160.7 82.04 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.521 0.677 . . . . 0.0 110.908 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 111.13 2.73 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.243 . . . . 0.0 112.316 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.509 ' HB3' HD22 ' A' ' 472' ' ' LEU . 74.2 m-85 -74.7 137.37 42.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.916 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -117.28 128.21 54.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.866 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 7.6 t -69.68 119.25 13.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.894 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -82.98 1.23 40.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -88.75 -44.2 10.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 17.8 p -122.11 -35.03 3.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.868 -179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 110.88 21.67 6.62 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.47 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 22.5 mttp -88.05 124.32 33.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 22.7 t -92.14 149.56 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.115 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -130.19 -175.87 3.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.905 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.65 -28.46 6.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.902 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 56.9 mtt-85 -122.59 136.69 54.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.88 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -53.87 -34.97 60.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 65.7 m -64.97 -40.11 94.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.866 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 39.1 m170 -59.16 -32.4 69.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.818 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.509 HD22 ' HB3' ' A' ' 457' ' ' TYR . 12.8 tp -78.72 -35.06 45.43 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.33 -51.8 67.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.087 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 64.8 mtm-85 -66.57 -28.21 68.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.899 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.65 ' O ' HG22 ' A' ' 478' ' ' ILE . 67.9 t60 -70.04 -40.81 74.93 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -56.08 -25.31 44.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.897 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 46.3 mt -55.34 -33.59 63.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.946 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' O ' ' A' ' 475' ' ' HIS . 12.8 tt -67.0 -25.0 33.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -93.12 -53.56 4.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.875 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 20.7 p -72.57 124.17 24.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.162 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -141.12 93.8 0.19 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.471 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 22.4 mp0 -129.51 60.29 1.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.896 0.379 . . . . 0.0 110.861 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.8 mtpt 56.75 73.66 0.78 Allowed Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.588 0.709 . . . . 0.0 110.868 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 -179.21 2.76 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.647 2.231 . . . . 0.0 112.391 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 24.1 p -142.6 126.01 16.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.859 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -135.75 175.62 20.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.5 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 155.99 64.5 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.724 2.283 . . . . 0.0 112.306 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 91.8 p -116.35 177.93 4.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.857 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 15.4 t -93.07 125.24 37.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.876 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 CA-C-O 119.148 -0.807 . . . . 0.0 112.443 179.985 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 36.7 t -95.25 78.29 3.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.858 0.361 . . . . 0.0 110.89 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 44.8 t -123.63 154.8 38.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.854 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -147.53 -134.75 2.55 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.513 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.7 t -167.33 127.69 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.886 0.374 . . . . 0.0 110.834 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 22.2 m -114.61 86.32 2.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.864 -179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -135.2 73.14 0.45 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.518 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 38.8 m -88.78 85.69 6.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.797 0.332 . . . . 0.0 111.098 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . 175.36 169.25 36.91 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.484 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -83.52 108.18 16.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.95 0.405 . . . . 0.0 110.896 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 3.3 mmtm -84.71 160.71 55.44 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.569 0.7 . . . . 0.0 110.914 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 121.16 7.85 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.658 2.239 . . . . 0.0 112.323 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.733 ' HB3' HD22 ' A' ' 472' ' ' LEU . 44.0 m-85 -85.29 142.13 29.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.956 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.406 ' HG3' HG22 ' A' ' 465' ' ' VAL . 42.2 tttp -121.05 131.26 54.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.899 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 6.2 t -70.69 120.03 15.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.864 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -85.32 -0.3 54.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -89.91 -34.58 16.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 9.1 p -128.6 -39.36 1.65 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.888 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.65 22.29 5.79 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 15.9 mtmm -92.64 124.89 36.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.826 0.346 . . . . 0.0 110.885 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.406 HG22 ' HG3' ' A' ' 458' ' ' LYS . 42.1 t -94.39 146.73 6.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.119 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -124.48 -175.85 3.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.874 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -98.78 -49.82 4.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.849 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 3.4 ptp85 -119.34 148.22 43.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.848 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -52.0 -39.84 60.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.893 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.4 p -56.5 -39.31 73.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.815 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 34.0 m170 -68.0 -30.44 69.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.855 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 457' ' ' TYR . 13.1 tp -80.67 -39.18 27.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.939 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -56.12 -48.16 76.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.137 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 37.0 mmm-85 -63.22 -28.43 70.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.652 ' O ' HG22 ' A' ' 478' ' ' ILE . 78.8 t60 -74.55 -39.12 62.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.898 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -55.85 -25.55 42.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 48.3 mt -55.05 -31.95 61.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.893 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.652 HG22 ' O ' ' A' ' 475' ' ' HIS . 13.1 tt -69.25 -25.62 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.117 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -92.02 -44.12 9.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 11.2 t -135.84 133.9 38.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.181 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -164.83 121.12 0.98 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.475 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 63.9 tt0 -87.98 90.04 8.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.916 0.388 . . . . 0.0 110.882 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.9 tptt 57.55 73.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.593 0.711 . . . . 0.0 110.859 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 90.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.698 2.265 . . . . 0.0 112.333 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 1.8 p -65.72 -60.61 2.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.881 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -59.81 176.12 3.49 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.469 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 140.1 41.76 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.682 2.255 . . . . 0.0 112.364 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 4.1 m -128.66 -179.68 5.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.822 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 3.1 p -71.79 -36.58 70.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.874 -179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 CA-C-O 119.155 -0.803 . . . . 0.0 112.436 179.988 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.268 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 16.7 t -123.25 -37.35 2.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.923 0.392 . . . . 0.0 110.876 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 2.1 m -96.27 147.82 23.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.884 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -152.82 82.13 0.17 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.462 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 63.2 m -66.18 -176.57 0.43 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.888 -179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 1.3 t -128.71 -63.94 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 84.47 135.04 2.99 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.471 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 16.2 p -92.86 124.34 36.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.757 0.313 . . . . 0.0 111.208 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -145.71 175.21 25.35 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.505 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -70.08 156.04 39.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.392 . . . . 0.0 110.883 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -123.85 70.25 48.48 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.533 0.683 . . . . 0.0 110.887 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 133.4 25.49 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 0.0 112.365 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.591 ' HB3' HD22 ' A' ' 472' ' ' LEU . 33.6 m-85 -77.23 143.34 39.03 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.919 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.496 ' HG3' HG22 ' A' ' 465' ' ' VAL . 40.7 tttt -123.74 111.2 15.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.893 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 9.8 t -51.98 120.19 5.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.907 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -85.77 4.44 36.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -90.08 -45.33 9.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.881 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 21.2 p -121.88 -34.73 3.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.901 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 112.19 23.97 5.3 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.507 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 45.0 mttm -90.21 129.43 36.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.866 0.365 . . . . 0.0 110.861 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.496 HG22 ' HG3' ' A' ' 458' ' ' LYS . 21.8 t -95.71 149.91 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -137.41 157.77 45.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.867 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 54.7 mmm-85 -63.7 -72.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 mtt-85 -101.8 178.28 4.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -75.57 -35.13 60.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.867 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 3.0 p -52.23 -50.72 61.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 62.6 m80 -58.15 -38.87 77.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.891 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.591 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.3 tp -70.71 -28.95 65.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.876 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -57.13 -57.75 11.23 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.087 179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -59.54 -26.3 65.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.891 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.624 ' O ' HG22 ' A' ' 478' ' ' ILE . 85.6 t60 -83.33 -18.71 38.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.878 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.32 -17.54 51.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.88 -179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 10.6 mt -95.7 26.27 4.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.862 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 475' ' ' HIS . 10.1 tt -114.04 -26.63 2.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.133 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -87.47 -38.68 15.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.84 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 2.2 t -108.55 151.0 26.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.143 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 153.93 -88.07 0.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.482 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -98.22 67.67 1.88 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.892 0.377 . . . . 0.0 110.866 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 57.9 tttt -163.64 73.45 1.83 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.565 0.697 . . . . 0.0 110.867 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 121.85 8.53 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.674 2.249 . . . . 0.0 112.332 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 10.6 p -57.39 156.59 7.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -141.69 172.0 24.17 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.48 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 108.9 2.19 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.653 2.235 . . . . 0.0 112.355 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 59.0 p -106.93 -37.78 6.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.889 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 1.8 t -125.53 144.9 50.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.847 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 CA-C-O 119.136 -0.813 . . . . 0.0 112.512 -179.991 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.516 -0.234 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 19.0 m -121.57 179.01 4.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.91 0.386 . . . . 0.0 110.843 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 14.2 t -129.07 133.82 47.84 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -57.91 107.49 1.08 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.474 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 1.5 p -70.8 -53.65 14.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.879 0.371 . . . . 0.0 110.829 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.7 p -96.25 153.97 17.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 -179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -137.81 -110.33 0.96 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.448 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 8.0 t -145.86 142.38 28.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.834 0.349 . . . . 0.0 111.12 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -154.3 -161.6 10.57 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.476 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -103.16 -38.38 7.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.925 0.393 . . . . 0.0 110.911 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 45.2 tttp -152.33 68.32 7.13 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.622 0.725 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 122.94 9.63 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.702 2.268 . . . . 0.0 112.337 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.481 ' HB3' HD22 ' A' ' 472' ' ' LEU . 27.2 m-85 -78.2 147.94 34.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.947 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -128.98 112.09 13.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.913 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 11.2 t -57.4 120.61 8.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.899 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 6.4 t-160 -81.8 -12.81 58.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -69.39 -45.27 69.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.874 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 6.9 p -119.3 -42.0 2.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.852 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.23 23.93 4.01 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.481 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 13.2 mttp -91.77 137.41 32.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.798 0.332 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.6 t -99.24 150.11 5.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.16 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -135.0 161.99 33.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.843 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 78.0 mtt180 -62.01 -73.49 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.904 -179.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.3 mtt180 -113.44 -176.25 2.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.838 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -70.0 -36.94 75.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.899 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.2 m -55.36 -37.99 68.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -68.29 -45.46 72.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.841 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.481 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.8 tp -67.41 -32.46 73.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.918 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.0 -53.9 36.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.112 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 22.4 mmt-85 -64.22 -26.26 68.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.858 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.583 ' O ' HG22 ' A' ' 478' ' ' ILE . 77.9 t60 -77.37 -23.94 50.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.841 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 -72.91 -10.32 59.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.953 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.23 25.16 7.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.889 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.3 tt -112.79 -26.71 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.101 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -85.55 -37.51 19.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.897 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 70.7 p -58.04 -37.34 74.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 107.19 173.65 22.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.495 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -110.54 -70.07 0.83 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.921 0.391 . . . . 0.0 110.903 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -133.41 160.27 69.28 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.552 0.691 . . . . 0.0 110.918 179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 -13.85 35.38 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.7 2.267 . . . . 0.0 112.348 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 21.2 m -76.13 143.9 40.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.843 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 146.28 172.65 16.8 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.504 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 83.76 0.68 Allowed 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.68 2.253 . . . . 0.0 112.329 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 1.1 m -78.65 84.14 4.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.833 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 15.8 m -152.73 161.35 42.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.854 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 CA-C-O 119.166 -0.797 . . . . 0.0 112.528 -179.959 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 5.4 p -86.34 93.5 9.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.834 0.35 . . . . 0.0 110.895 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 22.3 t -148.49 147.48 29.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.868 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 96.03 127.78 5.47 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.46 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 43.4 t -144.92 153.27 41.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.875 0.369 . . . . 0.0 110.849 -179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 5.0 m -135.27 171.55 14.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.88 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 146.98 78.57 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.48 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 29.2 m -156.02 130.08 8.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.837 0.351 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -154.22 77.21 0.21 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.485 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -98.85 28.44 4.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.947 0.403 . . . . 0.0 110.893 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -65.64 160.65 59.11 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.571 0.7 . . . . 0.0 110.929 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 129.08 17.01 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.698 2.266 . . . . 0.0 112.364 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.723 ' HB3' HD22 ' A' ' 472' ' ' LEU . 42.4 m-85 -76.16 138.48 40.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.936 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -119.27 129.89 55.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.871 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.31 119.29 17.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.917 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -79.46 -7.63 58.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.849 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -76.4 -49.09 17.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.937 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 8.1 p -117.2 -40.35 3.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.888 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.79 21.41 4.63 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.46 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 34.2 mttm -88.46 128.09 35.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.815 0.34 . . . . 0.0 110.92 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.81 146.85 7.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.129 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -127.02 -176.42 3.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 17.4 tpt180 -94.03 -67.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.867 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -105.58 150.99 24.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -52.0 -30.05 23.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 1.9 t -58.28 -49.89 75.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.859 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 33.2 m170 -57.41 -44.09 84.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.863 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.723 HD22 ' HB3' ' A' ' 457' ' ' TYR . 9.0 tp -67.36 -32.39 73.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.898 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -52.04 -54.63 27.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.064 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.57 -26.05 68.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.866 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.614 ' O ' HG22 ' A' ' 478' ' ' ILE . 83.0 t60 -79.43 -18.73 51.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.847 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -79.49 -16.77 55.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.967 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 12.7 mt -95.67 25.96 4.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.614 HG22 ' O ' ' A' ' 475' ' ' HIS . 9.8 tt -112.89 -26.67 2.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.105 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -89.37 -37.84 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.844 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 57.5 p -52.49 119.86 4.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.184 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 161.02 -89.15 0.11 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.515 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 57.69 46.08 17.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.863 0.363 . . . . 0.0 110.845 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 34.0 tttt -161.68 71.49 2.46 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.54 0.686 . . . . 0.0 110.922 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 119.62 6.54 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.657 2.238 . . . . 0.0 112.357 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 15.4 m -59.28 127.24 31.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.833 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . -148.81 -176.2 21.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.461 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 101.6 0.93 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.722 2.281 . . . . 0.0 112.346 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 49.5 m -54.76 152.97 6.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 13.7 t -162.18 111.32 1.46 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.871 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 CA-C-O 119.154 -0.803 . . . . 0.0 112.506 -179.992 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.449 -0.26 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' SER . . . . . . . . . . . . . 11.1 p -111.26 66.74 0.63 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.382 . . . . 0.0 110.841 -179.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' SER . . . . . . . . . . . . . 7.8 t -57.77 144.32 38.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.884 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 93.2 37.88 5.53 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.456 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' SER . . . . . . . . . . . . . 11.7 t -85.74 96.84 9.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.888 0.375 . . . . 0.0 110.819 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 52.8 m -54.9 158.09 2.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.869 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -101.57 105.6 2.89 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' THR . . . . . . . . . . . . . 14.8 t -95.83 167.88 10.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.872 0.368 . . . . 0.0 111.13 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' GLY . . . . . . . . . . . . . . . -87.73 81.39 1.62 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.495 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -80.22 118.67 22.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.945 0.402 . . . . 0.0 110.905 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? 52.14 68.38 3.21 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.526 0.679 . . . . 0.0 110.877 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 126.03 12.81 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.678 2.252 . . . . 0.0 112.31 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' TYR . . . . . 0.47 ' HB3' HD22 ' A' ' 472' ' ' LEU . 77.2 m-85 -66.28 141.87 57.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.905 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' LYS . . . . . 0.466 ' HG3' HG22 ' A' ' 465' ' ' VAL . 77.2 tttt -127.79 109.73 11.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.897 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' CYS . . . . . . . . . . . . . 10.6 t -53.17 119.37 4.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.892 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -81.1 -16.39 53.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.837 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -63.68 -47.19 82.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.905 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' CYS . . . . . . . . . . . . . 7.5 p -118.07 -41.74 2.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.88 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' GLY . . . . . . . . . . . . . . . 116.61 27.04 2.92 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' LYS . . . . . . . . . . . . . 31.2 mttm -95.75 132.27 41.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.823 0.344 . . . . 0.0 110.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 ' HG3' ' A' ' 458' ' ' LYS . 46.5 t -94.57 147.05 5.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.147 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -129.66 139.39 51.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.849 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -52.09 -44.68 64.51 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.877 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 73.3 mtt180 -135.59 170.03 16.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.867 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -67.58 -36.81 81.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.926 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 4.9 p -52.11 -34.95 46.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.865 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -77.63 -34.86 53.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.868 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' LEU . . . . . 0.47 HD22 ' HB3' ' A' ' 457' ' ' TYR . 7.5 tp -73.03 -28.68 62.49 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.984 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' ALA . . . . . . . . . . . . . . . -59.37 -56.96 15.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.108 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 18.3 mmt180 -60.52 -26.05 66.57 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.873 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' HIS . . . . . 0.594 ' O ' HG22 ' A' ' 478' ' ' ILE . 70.7 t60 -79.73 -24.02 41.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -71.8 -9.75 58.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.879 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 14.1 mt -98.82 24.64 7.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 475' ' ' HIS . 14.6 tt -112.57 -26.62 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.17 179.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -86.65 -36.27 18.87 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' THR . . . . . . . . . . . . . 3.2 t -109.09 -26.74 9.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.158 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 53.78 80.46 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.47 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -78.25 -39.34 40.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.383 . . . . 0.0 110.871 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -106.56 159.26 30.47 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.571 0.7 . . . . 0.0 110.916 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 80.23 0.89 Allowed 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.659 2.239 . . . . 0.0 112.355 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 3.4 t -168.68 153.93 6.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' GLY . . . . . . . . . . . . . . . 148.26 178.02 23.06 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.483 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 -35.43 12.9 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.649 2.233 . . . . 0.0 112.379 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' SER . . . . . . . . . . . . . 15.9 p -112.0 114.96 28.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.84 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' SER . . . . . . . . . . . . . 6.0 t -79.46 -43.43 23.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.873 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 CA-C-O 119.102 -0.832 . . . . 0.0 112.503 -179.977 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_