data_2cqe_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 2cqe _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 ' 433' ' ' LYS . . . . . . . . . . . . . 18.4 mmtp . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.15 43.01 1.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.86 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 436' ' ' LEU . 51.3 tp10 -114.52 162.54 16.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.916 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 435' ' ' GLU . 26.4 tp -74.65 104.72 5.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 34.9 t -42.41 135.3 2.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.462 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -71.1 -5.6 32.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.925 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -105.48 -49.4 3.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.564 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 40.6 t80 -43.27 -35.42 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -44.11 -39.1 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 58.6 p -100.32 -37.78 8.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.04 -4.52 18.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . 0.476 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 9.2 t80 -99.54 77.65 2.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.23 107.37 15.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.888 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.41 -59.0 1.41 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.102 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -84.77 111.12 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.14 -76.85 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.062 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -81.56 -5.21 57.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -99.4 6.83 45.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.869 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 44.8 t -80.09 111.41 21.79 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 1.5 4.34 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.692 2.261 . . . . 0.0 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -102.05 179.6 4.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 18.9 mmm -95.48 143.32 26.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.93 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.564 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 21.9 m170 -120.51 -77.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.18 -63.2 1.9 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.52 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.8 m-20 -34.0 -46.65 0.24 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.789 0.328 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -43.17 129.36 3.42 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.591 0.71 . . . . 0.0 110.907 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 146.03 59.04 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.3 t -69.01 145.28 53.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.88 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -80.09 -65.6 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.1 mt -44.73 -58.64 2.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -39.61 -25.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.49 ' N ' ' O ' ' A' ' 462' ' ' LEU . 43.8 m-70 -100.29 -52.46 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.855 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 464' ' ' HIS . 70.7 p -31.61 -45.31 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.15 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 76.7 p -126.01 -34.66 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.89 -37.69 1.98 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.499 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -108.58 140.73 41.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 110.866 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.3 t -100.55 135.18 42.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.6 tp -61.2 -42.03 91.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.156 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 -51.84 -57.48 9.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 116.12 -149.0 18.88 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -75.76 -16.03 60.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 110.866 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.18 44.41 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.832 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 t -79.48 147.96 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.572 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.3 ppp? -76.14 -11.15 59.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.572 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.3 m-85 -107.96 160.19 15.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 74.8 m -77.77 143.48 37.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -114.73 31.79 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.841 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -72.87 159.43 85.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.606 0.717 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 120.86 7.58 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.687 2.258 . . . . 0.0 112.37 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.425 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 27.1 mt -42.99 148.51 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.7 p -131.11 154.77 47.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.156 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -39.95 -31.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -80.01 -74.13 0.32 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 70.1 p -42.83 -46.33 5.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.18 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.16 -46.5 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -55.9 -38.33 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.837 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 34.7 mt -53.03 -65.86 0.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.921 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 84.3 mt -40.64 -56.6 2.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -39.95 -43.36 1.51 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.15 -59.94 2.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -41.41 -59.4 1.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.868 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.442 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 24.2 mttm . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.79 0.329 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.472 ' HB3' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -120.53 48.34 1.62 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -139.47 154.66 47.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.513 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 14.5 tp -70.16 143.26 52.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 22.6 t -74.11 146.69 43.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.892 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.476 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.2 OUTLIER -77.35 -12.5 59.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.912 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -104.49 -48.36 3.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 37.7 t80 -42.94 -36.38 1.52 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.941 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.2 mt -40.1 -36.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.76 -34.68 10.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.96 -9.03 21.25 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -98.86 81.93 2.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.821 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.1 t -118.26 100.32 7.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.06 -59.61 1.43 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.103 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -74.46 96.19 2.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.18 -76.34 0.23 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.145 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.56 20.3 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -124.98 -1.32 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.2 t -80.16 111.24 20.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.644 0.735 . . . . 0.0 110.925 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 0.26 5.88 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.664 2.243 . . . . 0.0 112.348 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.442 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 78.5 m-85 -100.01 175.69 5.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 48.8 mmm -90.09 143.34 26.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.898 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.515 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 22.2 m170 -120.03 -75.85 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.28 -68.15 1.5 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.467 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.452 ' C ' ' O ' ' A' ' 456' ' ' GLY . 5.9 m-20 -34.5 -35.53 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.844 0.354 . . . . 0.0 110.862 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.513 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 20.7 t80 -51.81 124.05 26.45 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.663 0.744 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 140.99 43.87 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.721 2.281 . . . . 0.0 112.291 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.36 142.12 55.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -76.81 -65.59 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.9 mt -44.99 -58.25 3.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -40.72 -23.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.56 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.9 m-70 -100.37 -51.49 3.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.878 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.464 ' C ' ' O ' ' A' ' 464' ' ' HIS . 49.0 p -31.37 -40.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 464' ' ' HIS . 75.6 p -132.93 -32.75 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.53 -34.81 2.3 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -110.0 149.21 30.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 15.0 t -104.24 151.43 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.1 tp -79.33 -37.13 18.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.112 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -49.89 -65.94 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 139.67 -169.39 24.64 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.527 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.19 -24.54 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.35 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -104.9 46.92 0.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.75 147.62 47.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.528 ' SD ' ' CE1' ' A' ' 477' ' ' PHE . 5.2 ppp? -79.67 11.74 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.851 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.528 ' CE1' ' SD ' ' A' ' 476' ' ' MET . 14.0 m-85 -123.07 155.71 36.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 8.0 m -75.36 127.09 32.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -103.03 16.12 27.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.03 156.44 74.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.647 0.737 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 121.26 7.94 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.687 2.258 . . . . 0.0 112.342 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.56 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 59.3 mt -41.49 144.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.921 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 485' ' ' GLU . 4.4 p -138.11 158.12 44.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.162 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -38.69 -29.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 483' ' ' THR . 32.4 mt-10 -81.24 -75.77 0.27 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 489' ' ' LEU . 68.1 p -50.03 -47.52 53.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.139 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.09 -36.5 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -65.21 -41.61 94.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' A' ' 486' ' ' THR . 87.8 mt -46.9 -62.61 1.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 66.4 mt -40.32 -57.12 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -42.54 -38.24 1.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.853 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.98 -52.37 8.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.5 -60.83 2.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.932 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 25.0 mttm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.762 0.315 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -105.53 44.67 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -113.71 152.17 30.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.897 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.412 HD11 ' CD2' ' A' ' 458' ' ' PHE . 37.4 tp -63.12 114.63 3.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.976 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.71 131.99 52.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.91 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 15.47 1.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.41 -37.11 3.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.508 ' CZ ' ' HE2' ' A' ' 476' ' ' MET . 34.9 t80 -68.09 -35.9 78.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.88 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.0 mt -43.19 -33.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.5 p -102.08 -36.47 8.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 120.09 -10.15 11.05 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . 0.418 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 8.2 t80 -99.65 85.86 3.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.871 0.367 . . . . 0.0 110.913 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.1 t -121.16 110.49 16.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.56 -70.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.095 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -78.59 107.73 11.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.844 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -75.32 0.26 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.7 2.99 23.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -114.35 15.78 17.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 36.8 t -80.59 111.2 20.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.646 0.736 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 -0.88 7.5 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.694 2.263 . . . . 0.0 112.367 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -101.88 179.76 4.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 34.4 mmm -99.98 139.29 35.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.418 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 26.2 m170 -113.17 -78.34 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.13 -63.12 1.91 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.507 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 42.6 t0 -32.71 -45.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.828 0.346 . . . . 0.0 110.926 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.412 ' CD2' HD11 ' A' ' 436' ' ' LEU . 17.0 t80 -46.91 124.59 8.15 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.608 0.718 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 145.95 58.82 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.704 2.269 . . . . 0.0 112.333 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.475 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.5 t -64.48 144.41 57.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.843 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -79.33 -67.15 0.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.1 mt -44.63 -59.17 2.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -39.67 -25.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.546 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 34.8 m-70 -99.89 -51.72 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.442 ' HG1' ' N ' ' A' ' 466' ' ' THR . 44.5 p -35.58 -44.38 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.195 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.442 ' N ' ' HG1' ' A' ' 465' ' ' THR . 68.3 p -123.35 -35.03 3.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.37 -37.65 1.96 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.489 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -109.96 147.74 32.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.86 0.362 . . . . 0.0 110.855 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 38.2 t -103.2 147.56 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.879 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 4.5 tp -70.6 -42.36 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -51.91 -54.71 26.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 121.63 -153.24 16.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.434 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.44 -19.15 59.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.321 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -101.41 42.7 1.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.95 143.61 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.508 ' HE2' ' CZ ' ' A' ' 440' ' ' TYR . 5.3 ppp? -80.93 19.32 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.415 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 26.3 m-85 -126.38 158.61 35.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.882 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 13.2 m -76.47 120.29 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -100.84 32.66 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.821 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -77.71 161.51 71.45 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.588 0.709 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 116.93 4.79 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.712 2.275 . . . . 0.0 112.311 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.546 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 28.6 mt -40.98 150.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.2 p -133.27 154.92 50.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.154 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -40.48 -33.26 0.25 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -80.16 -74.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.439 ' HA ' ' CD1' ' A' ' 489' ' ' LEU . 32.1 p -46.95 -52.98 13.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.96 -44.55 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -59.64 -38.29 80.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.439 ' CD1' ' HA ' ' A' ' 486' ' ' THR . 55.0 mt -52.21 -65.54 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.936 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.424 ' CD1' HD22 ' A' ' 482' ' ' LEU . 78.1 mt -42.25 -57.59 2.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -39.89 -42.31 1.31 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -79.53 -48.32 14.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.913 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -51.5 -58.76 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.925 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.782 0.325 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -123.62 46.21 2.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -114.45 165.72 12.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.555 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 27.2 tp -71.71 115.92 11.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.54 125.22 22.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -66.26 -3.76 6.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -100.08 -55.36 2.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.557 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 10.2 t80 -43.91 -36.36 2.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 39.5 mt -43.74 -38.44 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -35.02 9.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.53 -9.78 11.64 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -99.73 96.16 7.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.891 0.377 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 36.5 t -130.64 102.16 6.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.095 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -67.69 82.71 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -78.73 -57.47 3.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.058 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.88 -2.03 31.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.956 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 36.0 m-20 -134.85 37.49 3.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 53.2 t -80.76 111.04 19.87 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 110.896 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -2.5 10.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.712 2.275 . . . . 0.0 112.342 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -108.31 -177.24 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.893 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 38.3 mmm -100.26 147.78 25.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.557 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 23.4 m170 -122.57 -77.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.438 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.68 -65.73 1.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.488 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.4 m-20 -34.73 -39.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.555 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.7 t80 -50.44 124.59 18.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 0.0 110.826 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 141.08 44.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.339 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.0 t -65.9 141.07 58.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -78.01 -66.8 0.8 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.884 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.1 mt -45.37 -56.67 4.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -40.81 -24.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.495 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 40.9 m-70 -100.61 -53.66 3.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.862 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 464' ' ' HIS . 69.8 p -31.1 -41.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.15 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.431 ' N ' ' O ' ' A' ' 464' ' ' HIS . 39.2 p -129.81 -36.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 136.22 -37.85 1.84 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -106.66 142.74 35.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -100.51 144.45 29.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.6 tp -71.9 -36.57 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.149 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -52.21 -60.03 3.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.921 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 125.72 -156.01 19.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.512 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -71.97 -27.59 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 110.89 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -101.47 44.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -73.91 146.48 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.1 ppp? -80.6 17.52 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 25.4 m-85 -128.23 154.81 45.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.9 m -78.55 126.9 31.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -100.11 19.2 16.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.86 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.28 155.14 58.89 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.596 0.712 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 116.17 4.43 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.74 2.293 . . . . 0.0 112.324 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.495 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 12.7 mt -40.61 132.41 2.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' THR . . . . . 0.52 ' O ' ' CB ' ' A' ' 487' ' ' ARG . 69.2 p -112.71 167.13 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -49.61 -31.86 11.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -81.26 -77.0 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.885 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 49.9 p -45.62 -36.94 5.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.152 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 483' ' ' THR . 12.5 tpt180 -48.71 -40.92 30.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.859 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -61.45 -45.76 92.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 45.1 mt -41.41 -67.01 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.454 ' CD1' HD13 ' A' ' 482' ' ' LEU . 77.4 mt -40.78 -59.41 1.41 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -39.7 -41.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.87 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -79.63 -50.58 10.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.3 tmm? -57.93 -62.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.926 179.967 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.499 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 3.7 mmmp? . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.791 0.329 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.43 ' O ' ' CD2' ' A' ' 489' ' ' LEU . 5.7 tpt180 61.01 40.98 14.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -135.12 160.86 37.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.558 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 43.6 tp -60.75 112.92 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . 0.486 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 5.9 t -53.24 115.49 1.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -56.03 -12.18 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -101.0 -48.46 4.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.486 ' CB ' ' HB3' ' A' ' 437' ' ' CYS . 25.1 t80 -45.38 -40.75 8.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 54.1 mt -39.95 -31.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.116 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 81.7 p -102.15 -36.6 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.44 11.68 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.487 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -96.96 88.53 4.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.907 0.384 . . . . 0.0 110.848 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 12.6 t -126.37 110.49 13.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.76 -72.05 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.067 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 64.5 mtt180 -73.63 102.41 3.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.1 -72.14 0.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.112 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -76.43 -7.33 54.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.892 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . 0.41 ' OD1' ' N ' ' A' ' 450' ' ' ASN . 0.5 OUTLIER -118.93 30.26 7.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.892 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 44.7 t -73.97 113.39 22.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.725 . . . . 0.0 110.865 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 7.11 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.26 . . . . 0.0 112.361 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.499 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 49.3 m-85 -118.38 -175.23 2.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 27.4 mmm -101.15 134.85 43.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.5 m170 -113.58 -76.66 0.58 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.829 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.499 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -77.97 -70.64 1.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.499 ' C ' ' O ' ' A' ' 456' ' ' GLY . 2.6 m-20 -29.54 -42.84 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 0.0 110.862 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.558 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 17.9 t80 -48.16 125.84 11.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.668 0.747 . . . . 0.0 110.866 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 126.99 13.97 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.38 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.7 t -49.88 149.42 2.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -80.11 -67.9 0.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.504 ' O ' ' N ' ' A' ' 464' ' ' HIS . 48.0 mt -43.78 -60.42 1.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.422 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 92.4 t80 -39.22 -25.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.549 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.4 m-70 -99.0 -53.23 3.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 73.4 p -32.61 -43.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.142 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 82.7 p -127.37 -35.92 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.153 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.422 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.02 -40.42 1.45 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -105.04 172.65 6.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.3 t -129.56 119.18 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.905 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -51.94 -30.27 12.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -50.45 -63.35 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 143.57 -162.44 27.67 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.528 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.1 -37.6 75.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.864 0.364 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -99.88 65.14 1.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.887 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 20.9 t -78.18 151.88 32.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.8 ppp? -69.86 -19.41 63.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 20.5 m-85 -101.46 155.99 17.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 35.1 m -78.66 142.92 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.853 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -115.18 35.15 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.22 161.17 80.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.596 0.712 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 116.5 4.59 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.645 2.23 . . . . 0.0 112.348 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.549 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.0 mt -40.53 146.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.914 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 77.3 p -125.26 156.25 38.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.126 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -40.42 -33.57 0.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -80.46 -75.21 0.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 20.3 p -41.17 -49.52 3.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.18 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -46.92 2.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.97 -45.98 91.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.43 ' CD2' ' O ' ' A' ' 434' ' ' ARG . 80.7 mt -45.4 -62.24 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.946 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.418 ' CD1' HD21 ' A' ' 482' ' ' LEU . 38.8 mt -41.86 -61.31 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.906 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.8 -47.6 2.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -68.4 -43.47 77.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' MET . . . . . 0.406 ' CE ' HD23 ' A' ' 494' ' ' LEU . 14.5 tmm? -56.92 -60.34 3.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.417 HD23 ' N ' ' A' ' 494' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.456 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 26.2 mmmt . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.459 ' CG ' HD22 ' A' ' 489' ' ' LEU . 16.7 tpp180 60.64 35.74 19.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -128.02 176.31 7.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.568 HD13 ' CD2' ' A' ' 458' ' ' PHE . 33.8 tp -75.39 121.87 22.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.962 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . 0.441 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.2 t -59.82 131.38 50.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.889 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 2.05 7.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -119.0 -40.56 2.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.455 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 34.5 t80 -54.46 -28.37 43.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.8 mt -45.57 -32.4 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 p -102.31 -29.7 11.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.19 -10.33 17.57 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.497 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -99.98 97.95 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.848 0.356 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 11.6 t -131.63 108.01 9.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.896 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.65 -66.19 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.096 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.445 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 19.2 mtm-85 -71.19 104.89 3.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.861 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -77.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -81.7 -2.79 51.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -114.11 24.6 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.3 t -80.18 114.54 47.72 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.873 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.68 3.34 Favored 'Trans proline' 0 C--O 1.231 0.13 0 C-N-CA 122.675 2.25 . . . . 0.0 112.369 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.456 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 75.6 m-85 -115.53 -174.37 2.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 31.8 mmm -100.03 150.19 22.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.877 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.455 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 30.3 m170 -125.65 -77.21 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -81.13 -60.09 2.32 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.465 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -39.32 -43.46 1.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.568 ' CD2' HD13 ' A' ' 436' ' ' LEU . 20.3 t80 -46.61 127.7 8.21 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.662 0.744 . . . . 0.0 110.903 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 140.27 42.14 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.7 146.34 49.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 34.4 tttp -80.14 -68.72 0.65 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.902 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.7 mt -44.89 -56.85 4.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.443 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 44.7 t80 -40.0 -27.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.557 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 32.5 m-70 -98.63 -52.69 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.422 ' C ' ' O ' ' A' ' 464' ' ' HIS . 31.9 p -34.21 -35.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 464' ' ' HIS . 76.8 p -132.74 -39.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.124 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.443 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.82 -38.99 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.501 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -109.14 152.16 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.859 0.362 . . . . 0.0 110.895 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 37.9 t -105.35 141.44 36.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.1 tp -72.91 -31.94 37.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -50.83 -68.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 144.45 -157.19 27.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.51 -29.06 61.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.779 0.323 . . . . 0.0 110.864 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.51 53.91 0.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.2 t -73.61 148.47 42.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.487 ' SD ' ' CZ ' ' A' ' 477' ' ' PHE . 4.4 ppp? -79.3 11.05 3.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.881 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.487 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 12.6 m-85 -124.59 158.1 33.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 2.8 m -76.8 134.02 39.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -109.33 20.27 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.826 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.79 158.92 81.63 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.601 0.715 . . . . 0.0 110.86 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 117.85 5.33 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.672 2.248 . . . . 0.0 112.374 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.557 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 88.8 mt -39.29 140.1 0.46 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 12.1 p -120.44 154.56 35.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -41.1 -29.12 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -79.97 -75.56 0.25 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.89 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.2 p -46.25 -47.88 18.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.121 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -39.68 -39.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.25 -38.91 91.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.479 ' N ' ' O ' ' A' ' 486' ' ' THR . 84.2 mt -50.44 -61.66 2.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 57.1 mt -41.43 -55.72 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -39.71 -45.37 1.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.861 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.17 -36.87 39.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -65.27 -66.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 16.2 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 49.5 mttp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.79 0.328 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.401 ' C ' ' CD ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -91.28 33.65 0.97 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -107.99 143.94 35.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 31.7 tp -66.98 120.66 14.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 33.3 t -59.12 134.02 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -79.37 12.08 2.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -117.71 -41.94 2.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.559 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 23.4 t80 -59.14 -33.41 70.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 70.6 mt -42.83 -33.0 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.4 p -101.48 -37.13 8.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.138 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.5 -8.42 17.58 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -100.13 80.97 2.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.897 0.38 . . . . 0.0 110.865 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 47.1 t -118.56 104.62 10.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.96 -64.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -78.21 105.56 9.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.852 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.42 -77.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.91 14.3 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.838 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -113.29 -17.25 12.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.856 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 8.0 t -65.95 111.21 5.9 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.552 0.692 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 3.64 2.62 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.349 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -100.17 170.69 8.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 17.6 mmm -81.94 141.28 33.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -120.91 -77.61 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.8 -60.17 2.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.7 m-20 -34.45 -46.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.775 0.321 . . . . 0.0 110.832 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -46.65 126.21 8.09 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.664 0.745 . . . . 0.0 110.855 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 134.42 27.94 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.688 2.258 . . . . 0.0 112.331 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.4 t -53.16 145.19 14.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 21.0 tttm -80.12 -67.64 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.6 mt -44.76 -58.83 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.942 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.449 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 25.1 t80 -39.43 -25.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.96 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.515 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 30.4 m-70 -99.98 -54.15 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 464' ' ' HIS . 33.8 p -33.79 -40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 80.6 p -126.92 -33.18 2.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.127 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.449 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 131.81 -40.24 1.66 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.505 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -109.8 149.92 29.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 0.0 110.899 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.62 143.8 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.8 tp -71.34 -39.09 71.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.096 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.74 -68.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 141.58 -154.81 24.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.498 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -74.38 -24.49 59.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -101.69 49.27 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -79.26 148.08 32.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.559 ' HE2' ' CE2' ' A' ' 440' ' ' TYR . 3.6 ppp? -80.57 17.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.522 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 12.4 m-85 -129.43 157.38 42.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.5 p -80.07 128.68 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.877 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -103.87 21.94 15.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.46 158.67 86.26 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.614 0.721 . . . . 0.0 110.845 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 119.28 6.26 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.665 2.243 . . . . 0.0 112.387 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.515 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 39.8 mt -42.5 150.2 0.15 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.947 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.0 p -128.79 154.9 45.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.145 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -39.92 -30.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -80.66 -75.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 489' ' ' LEU . 20.7 p -46.99 -46.84 21.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.146 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -43.58 1.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -58.29 -40.5 82.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.937 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' A' ' 486' ' ' THR . 48.6 mt -49.87 -64.29 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 85.2 mt -42.99 -54.0 4.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -41.38 -44.9 2.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -78.07 -59.18 2.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -44.19 -60.14 2.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.895 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 55.4 mt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 -179.995 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.82 0.343 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.465 ' CG ' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -105.67 47.59 0.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.844 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -124.82 143.7 50.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.881 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.506 HD13 ' CD2' ' A' ' 458' ' ' PHE . 20.6 tp -73.59 102.65 3.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.89 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.8 t -40.02 124.1 1.76 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.883 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -68.05 -3.02 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -102.37 -51.52 3.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -47.78 -37.77 14.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.963 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.7 mt -41.17 -31.09 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.123 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 40.6 p -103.05 -33.93 9.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.94 -10.47 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.497 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -99.97 97.82 8.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 110.902 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.67 110.2 9.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.878 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.092 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 68.4 mtt180 -77.5 109.54 11.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.841 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.62 -77.16 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.125 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.74 5.8 17.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -103.29 -20.07 14.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.922 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 10.2 t -60.86 110.26 2.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.611 0.719 . . . . 0.0 110.872 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 4.27 2.29 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.8 178.33 4.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.918 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 22.7 mmm -91.62 140.42 29.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -120.59 -76.17 0.58 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.49 -64.95 1.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.495 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 28.0 t0 -32.6 -48.01 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.82 0.343 . . . . 0.0 110.871 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.506 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.9 t80 -40.55 125.92 1.84 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.759 . . . . 0.0 110.886 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 155.74 65.05 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.637 2.225 . . . . 0.0 112.36 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.514 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 14.0 t -73.5 146.03 45.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -79.54 -69.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.3 mt -44.14 -59.56 2.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.432 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 58.3 t80 -39.56 -25.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.552 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.7 m-70 -98.94 -50.83 4.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.823 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 464' ' ' HIS . 55.2 p -35.59 -43.24 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.427 ' N ' ' HG1' ' A' ' 465' ' ' THR . 32.5 p -125.96 -33.75 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.158 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.432 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 135.15 -38.12 1.84 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.514 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -108.56 166.24 10.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.2 t -126.25 131.77 51.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.4 tp -80.66 21.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -99.57 -46.89 5.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 114.81 174.31 18.24 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.503 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.5 -17.38 13.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -101.56 43.49 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.83 146.18 44.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.6 ppp? -71.59 -22.05 61.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.854 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 16.9 m-85 -100.55 159.19 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.6 m -79.94 135.9 36.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -101.02 24.46 9.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -62.51 153.44 77.16 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.582 0.705 . . . . 0.0 110.876 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 119.94 6.81 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.693 2.262 . . . . 0.0 112.355 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.552 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 80.0 mt -41.18 143.73 0.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 10.7 p -138.65 162.0 35.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.105 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -39.46 -35.63 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -80.22 -68.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.853 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 489' ' ' LEU . 5.7 p -52.89 -55.13 25.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.154 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.29 -49.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -52.24 -39.18 59.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.465 ' CD2' ' CG ' ' A' ' 434' ' ' ARG . 65.1 mt -49.6 -65.89 0.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.476 HD11 ' CD2' ' A' ' 464' ' ' HIS . 72.7 mt -39.81 -61.12 0.88 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.917 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.91 -39.56 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.842 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -79.47 -40.89 28.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -62.21 -59.76 4.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.872 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 452' ' ' PRO . 41.2 mttt . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.81 0.338 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.76 33.78 2.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.893 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -115.84 149.18 39.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.894 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 19.7 tp -79.39 105.45 10.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 439' ' ' PHE . 23.5 t -41.79 131.48 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -80.95 21.79 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.901 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . 0.4 ' H ' ' C ' ' A' ' 437' ' ' CYS . 24.8 m-85 -125.33 -42.2 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.905 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.566 ' CE2' ' HE3' ' A' ' 476' ' ' MET . 53.4 t80 -64.01 -27.7 69.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 96.5 mt -44.72 -37.19 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.3 -27.76 13.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.177 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.62 -10.17 16.45 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -100.73 105.76 17.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.891 0.377 . . . . 0.0 110.884 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 40.4 t -138.45 122.26 17.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.869 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -46.18 -67.45 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.155 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -86.12 114.47 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.64 -79.17 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.155 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -81.74 12.79 3.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -116.55 1.73 12.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.407 ' C ' ' H ' ' A' ' 453' ' ' TYR . 12.9 t -80.18 110.99 18.54 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.621 0.724 . . . . 0.0 110.866 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . 0.47 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.3 Cg_endo -69.77 7.08 1.08 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.407 ' H ' ' C ' ' A' ' 451' ' ' CYS . 59.3 m-85 -99.25 -177.15 3.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 44.3 mmm -97.84 126.25 43.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.873 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -109.95 -74.89 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.51 -60.28 2.37 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.458 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 51.6 m-20 -34.48 -45.46 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.858 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -47.03 128.77 9.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.654 0.74 . . . . 0.0 110.879 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 150.79 68.92 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.323 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.405 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.6 t -75.72 150.07 37.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 9.3 ttmt -80.01 -68.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.5 mt -45.5 -57.54 4.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 64.5 t80 -40.71 -24.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.567 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.9 m-70 -99.9 -53.39 3.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.45 ' HG1' ' N ' ' A' ' 466' ' ' THR . 43.6 p -34.7 -43.48 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.105 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.45 ' N ' ' HG1' ' A' ' 465' ' ' THR . 72.2 p -124.68 -35.23 2.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.13 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 136.46 -38.57 1.75 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.531 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -107.09 169.83 8.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 16.8 t -124.56 133.76 53.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.39 -38.84 82.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -50.28 -54.83 18.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 124.16 -159.35 18.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.449 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.77 -25.11 61.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.775 0.321 . . . . 0.0 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -99.95 47.21 0.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 33.9 t -78.1 149.41 33.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.6 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -80.66 18.54 0.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.6 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 20.2 m-85 -131.39 156.05 46.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.4 m -79.0 128.33 33.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.86 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -103.02 25.13 9.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.831 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.23 160.3 79.44 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.593 0.711 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 116.84 4.75 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.647 2.232 . . . . 0.0 112.359 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.567 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 37.8 mt -40.18 144.85 0.19 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 72.3 p -131.91 160.26 36.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -41.32 -32.67 0.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -78.27 -71.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.5 p -48.91 -51.15 31.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.126 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.47 -52.61 2.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.855 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -51.04 -49.7 60.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 94.2 mt -43.9 -65.18 0.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 35.9 mt -40.01 -57.32 1.66 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.7 -40.4 5.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.81 -52.43 9.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.3 tmm? -53.83 -64.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.933 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.796 0.332 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.467 ' HB3' ' CD2' ' A' ' 489' ' ' LEU . 8.2 mpt_? -92.63 41.67 1.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -122.12 152.68 39.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 13.4 tp -78.93 115.75 18.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 27.0 t -45.68 131.11 9.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -75.24 0.55 16.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -108.17 -50.11 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.508 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 11.7 t80 -49.05 -30.05 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.8 mt -44.46 -33.75 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.086 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 60.2 p -103.91 -29.23 11.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.107 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.11 -10.11 22.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -98.6 99.38 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.86 104.81 5.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.44 -61.78 0.87 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.134 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -81.92 104.64 12.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.08 -74.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.087 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -81.42 2.7 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.899 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -104.51 -5.26 21.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.3 t -72.56 111.59 11.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.624 0.726 . . . . 0.0 110.864 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 2.02 3.88 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.688 2.259 . . . . 0.0 112.388 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -100.32 -174.64 2.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 29.1 mmm -98.19 142.34 29.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.877 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -121.23 -75.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.469 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.69 -66.28 1.65 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.43 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.469 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -33.0 -42.57 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.863 0.363 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.502 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.8 t80 -46.79 126.93 8.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.684 0.754 . . . . 0.0 110.861 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 144.94 55.45 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.255 . . . . 0.0 112.333 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 51.9 t -69.26 143.24 53.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . 0.411 ' CD ' ' HE2' ' A' ' 493' ' ' MET . 4.7 ttpm? -79.38 -65.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.89 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.5 mt -45.0 -57.84 3.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -40.51 -24.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.572 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 45.1 m-70 -100.66 -52.49 3.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.458 ' C ' ' O ' ' A' ' 464' ' ' HIS . 58.3 p -32.24 -42.28 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.158 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 62.8 p -127.84 -36.92 1.97 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.15 -33.18 2.56 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.475 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -116.81 143.73 45.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.839 0.352 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.4 t -101.92 107.33 18.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . 0.424 HG23 ' N ' ' A' ' 471' ' ' ASN . 5.6 tp -40.49 -36.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.185 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . 0.424 ' N ' HG23 ' A' ' 470' ' ' ILE . 58.1 m-20 -53.2 -61.87 2.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 107.45 -142.07 15.74 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.18 13.43 2.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.841 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -106.72 -25.22 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.895 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -43.14 125.87 3.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.605 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 0.8 OUTLIER -81.56 27.2 0.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.1 m-85 -125.29 158.1 34.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.6 m -80.12 137.68 36.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.831 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 38.0 m170 -108.59 17.98 21.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -60.31 153.43 58.78 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 117.13 4.9 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.709 2.273 . . . . 0.0 112.351 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.572 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 23.7 mt -39.65 151.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 40.5 p -139.18 165.58 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.113 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . 0.409 ' HG3' ' CD ' ' A' ' 485' ' ' GLU . 9.9 pt-20 -40.27 -38.5 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.409 ' CD ' ' HG3' ' A' ' 484' ' ' GLU . 48.0 mp0 -80.43 -76.3 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.915 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.446 ' O ' ' N ' ' A' ' 489' ' ' LEU . 17.4 p -41.49 -50.92 3.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.124 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -39.41 -44.36 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.15 -40.08 80.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.467 ' CD2' ' HB3' ' A' ' 434' ' ' ARG . 88.3 mt -46.68 -68.14 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.454 HD11 ' CD1' ' A' ' 482' ' ' LEU . 92.8 mt -40.43 -57.55 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -42.54 -36.11 1.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -80.17 -38.47 31.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' MET . . . . . 0.411 ' HE2' ' CD ' ' A' ' 461' ' ' LYS . 11.3 tmm? -68.88 -62.64 1.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.829 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.896 -179.956 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.777 0.323 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 57.48 42.08 25.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -138.32 154.29 48.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.429 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 32.8 tp -79.54 105.09 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.7 t -40.52 123.78 1.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -69.41 -3.16 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -105.28 -51.43 3.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.423 ' HB2' ' NE2' ' A' ' 455' ' ' HIS . 31.6 t80 -44.58 -37.64 3.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -41.03 -36.24 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.147 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 11.1 p -101.21 -35.23 9.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.99 -9.81 11.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.489 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . 0.462 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 5.5 t80 -95.31 83.25 3.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.904 0.383 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 22.1 t -118.42 113.93 22.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -43.95 -72.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.114 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 84.2 mtt85 -80.17 109.41 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.65 -73.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -76.06 -5.66 47.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -110.47 20.34 17.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 37.6 t -80.53 111.81 25.99 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.629 0.728 . . . . 0.0 110.909 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 1.43 4.46 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.691 2.261 . . . . 0.0 112.359 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -105.67 -176.08 2.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' MET . . . . . 0.464 ' CE ' ' HB2' ' A' ' 457' ' ' ASP . 29.1 mmm -100.78 140.58 34.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.924 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.423 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.4 m170 -119.9 -75.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -78.13 -67.3 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.5 m-20 -32.99 -44.72 0.12 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.856 0.36 . . . . 0.0 110.884 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.429 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 15.2 t80 -45.28 126.24 5.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.633 0.73 . . . . 0.0 110.897 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 143.58 51.48 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.699 2.266 . . . . 0.0 112.341 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.432 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.1 t -70.69 145.03 50.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -77.25 -64.99 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.8 mt -44.73 -59.44 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.446 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 87.5 t80 -39.62 -25.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 462' ' ' LEU . 42.9 m-70 -98.87 -53.61 3.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.885 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 464' ' ' HIS . 51.2 p -34.48 -34.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.126 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.0 p -133.59 -40.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.124 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.446 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 141.22 -38.57 1.52 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.46 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.43 152.1 30.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.1 t -102.26 141.73 34.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.3 tp -80.23 -26.08 11.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -50.92 -49.61 59.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 129.64 -167.17 21.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.478 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.49 -35.79 79.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.831 0.348 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -100.57 58.8 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.66 149.08 40.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.934 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -76.51 6.57 5.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 15.7 m-85 -125.78 154.74 42.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.844 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 23.3 m -80.37 141.44 35.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.25 26.98 10.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -64.97 153.76 88.02 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.624 0.726 . . . . 0.0 110.869 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 109.66 2.35 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.698 2.266 . . . . 0.0 112.39 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.443 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 47.4 mt -39.73 152.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' N ' ' A' ' 485' ' ' GLU . 72.5 p -137.46 158.51 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -38.95 -30.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.858 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.2 mm-40 -81.4 -74.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.42 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.1 p -46.24 -47.61 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.14 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.11 -47.04 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.86 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -56.99 -41.38 78.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 486' ' ' THR . 74.1 mt -47.66 -63.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 72.1 mt -39.87 -60.03 1.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.929 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -40.26 -45.94 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.883 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 44.3 tttp -72.42 -49.11 35.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -48.23 -59.22 3.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 494' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.455 ' HD3' ' CE2' ' A' ' 453' ' ' TYR . 6.9 mtpt . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.752 0.31 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.464 ' HB3' ' CD2' ' A' ' 489' ' ' LEU . 0.1 OUTLIER 58.83 38.35 24.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.85 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.04 135.14 32.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 53.9 tp -60.61 117.42 5.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 439' ' ' PHE . 28.3 t -58.86 126.4 27.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.32 29.03 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . 0.4 ' H ' ' C ' ' A' ' 437' ' ' CYS . 36.1 m-85 -134.61 -42.09 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.605 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 47.1 t80 -66.91 -21.86 65.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.905 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 61.7 mt -52.84 -32.8 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.143 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 61.1 p -108.26 11.29 27.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.57 -8.73 25.67 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -99.67 99.62 10.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.3 t -136.26 117.25 14.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.09 -67.59 0.27 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.081 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -85.72 114.41 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.21 -76.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.128 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -81.41 -2.57 49.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -105.59 11.99 31.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 20.1 t -80.81 111.32 22.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.631 0.729 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 0.77 5.2 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.675 2.25 . . . . 0.0 112.331 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.455 ' CE2' ' HD3' ' A' ' 433' ' ' LYS . 57.6 m-85 -100.3 -174.97 2.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.4 mmm -100.54 143.03 31.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.922 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.476 ' CE1' ' HB2' ' A' ' 440' ' ' TYR . 13.6 m170 -122.04 -75.28 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.64 -69.44 1.4 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.466 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.491 ' C ' ' O ' ' A' ' 456' ' ' GLY . 20.3 t0 -31.05 -41.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.504 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 14.7 t80 -49.31 117.78 7.16 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.864 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 129.45 17.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.721 2.281 . . . . 0.0 112.311 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 138.17 13.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -73.99 -66.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 49.0 mt -45.02 -58.7 3.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' A' ' 467' ' ' GLY . 69.4 t80 -39.74 -24.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.578 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 44.4 m-70 -100.75 -53.19 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.826 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.4 p -29.64 -42.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.193 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 464' ' ' HIS . 65.9 p -126.66 -39.53 1.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 463' ' ' TYR . . . 146.72 -38.06 1.16 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.51 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . 0.401 ' C ' ' HA ' ' A' ' 463' ' ' TYR . 45.1 p-10 -113.83 168.93 9.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.855 0.359 . . . . 0.0 110.918 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.33 140.38 48.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -76.98 -33.28 20.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.102 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -50.42 -65.46 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 145.87 -164.35 28.2 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.502 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.15 -22.63 59.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.822 0.344 . . . . 0.0 110.888 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -99.76 48.89 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.409 ' C ' ' H ' ' A' ' 477' ' ' PHE . 54.1 t -79.46 141.32 36.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.605 ' CE ' ' CE2' ' A' ' 440' ' ' TYR . 4.7 ppp? -81.11 25.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 24.1 m-85 -134.59 157.23 47.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.86 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.5 p -80.1 135.47 36.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -111.49 28.15 9.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.881 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.47 163.32 69.1 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.608 0.718 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 120.08 6.92 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.701 2.268 . . . . 0.0 112.318 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.578 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.3 mt -40.91 143.79 0.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 39.4 p -126.54 156.09 41.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -39.87 -34.1 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -76.74 -74.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.879 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 489' ' ' LEU . 20.4 p -45.16 -50.44 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.146 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . 0.466 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.03 -49.59 1.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -50.83 -45.31 59.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.464 ' CD2' ' HB3' ' A' ' 434' ' ' ARG . 93.8 mt -48.2 -64.1 0.89 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 97.1 mt -39.82 -53.75 2.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -46.13 -47.33 17.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.843 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -73.66 -57.74 3.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.86 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -46.4 -64.23 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.869 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.44 HD11 ' N ' ' A' ' 494' ' ' LEU . 10.5 mp . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.953 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.537 ' HE3' ' CE1' ' A' ' 453' ' ' TYR . 22.6 mtmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 38.14 50.33 1.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . 0.471 ' HB3' ' CD2' ' A' ' 453' ' ' TYR . 14.2 tt0 -138.07 145.05 41.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.918 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.426 HD12 ' CD2' ' A' ' 458' ' ' PHE . 19.6 tp -72.99 112.26 8.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.938 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 18.5 t -43.28 141.75 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.461 ' HG2' ' CD1' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -79.89 -5.64 55.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.91 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . 0.461 ' CD1' ' HG2' ' A' ' 438' ' ' LYS . 46.3 m-85 -110.17 -54.03 2.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -42.2 -23.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.9 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 439' ' ' PHE . 61.8 mt -50.53 -40.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.107 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 41.3 p -99.71 6.24 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.158 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 79.87 -9.61 44.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.464 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -99.85 100.88 11.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.369 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.3 t -131.41 122.96 27.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.5 -59.08 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.118 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -88.65 107.96 19.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.81 -77.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -82.59 25.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -132.87 0.85 3.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.928 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.9 t -78.89 111.73 21.96 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.66 0.743 . . . . 0.0 110.869 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 5.17 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.716 2.277 . . . . 0.0 112.291 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.537 ' CE1' ' HE3' ' A' ' 433' ' ' LYS . 20.7 m-85 -99.93 -176.27 3.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.967 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.2 mmm -95.43 134.61 38.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -117.19 -75.51 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.29 -62.15 2.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.477 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 10.0 m-20 -34.74 -50.69 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 0.0 110.823 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.426 ' CD2' HD12 ' A' ' 436' ' ' LEU . 21.3 t80 -40.14 123.97 1.67 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 0.0 110.865 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 151.5 69.19 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.638 2.225 . . . . 0.0 112.322 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.543 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.8 t -73.95 145.96 44.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -78.76 -68.06 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.3 mt -44.25 -59.73 2.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.472 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 70.7 t80 -39.5 -25.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.924 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 30.2 m-70 -99.08 -52.93 3.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.429 ' C ' ' O ' ' A' ' 464' ' ' HIS . 53.1 p -34.75 -35.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.3 p -132.96 -37.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.472 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.34 -41.22 1.35 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.513 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.96 165.71 11.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.896 0.379 . . . . 0.0 110.87 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 47.5 t -117.9 150.16 39.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.9 tp -79.83 -34.85 15.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.154 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -53.54 -66.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 135.85 -171.08 22.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.445 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -35.02 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.818 0.342 . . . . 0.0 110.854 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -100.22 59.85 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 24.7 t -79.47 152.51 30.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.586 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 3.6 ppp? -68.73 -21.79 64.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.912 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.586 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.6 m-85 -105.51 159.41 15.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 27.3 m -79.12 140.38 37.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -104.24 24.34 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.16 154.6 60.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.6 0.714 . . . . 0.0 110.856 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 120.08 6.93 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.731 2.288 . . . . 0.0 112.347 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.514 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 41.1 mt -40.14 143.34 0.29 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 46.8 p -126.71 153.35 45.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.104 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 485' ' ' GLU . 4.3 pt-20 -40.26 -30.78 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 484' ' ' GLU . 11.5 tp10 -80.31 -73.64 0.35 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 60.2 p -45.0 -48.03 11.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.13 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.67 -42.27 1.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.832 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -61.31 -43.78 98.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.874 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 23.4 mt -45.03 -64.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 75.1 mt -39.87 -57.27 1.62 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.951 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.38 -43.58 1.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -79.0 -51.92 8.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.9 tmm? -53.69 -63.31 1.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 -179.994 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.766 0.317 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.02 54.19 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . 0.423 ' OE2' ' N ' ' A' ' 436' ' ' LEU . 0.8 OUTLIER -131.08 138.68 49.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 40.2 tp -57.91 114.42 2.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.8 t -47.72 138.42 8.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.92 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -77.02 -3.38 38.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -110.18 -51.06 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.56 ' CE2' ' HE1' ' A' ' 476' ' ' MET . 21.9 t80 -43.15 -35.75 1.47 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.8 mt -39.89 -37.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 16.5 p -99.35 -36.01 9.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.162 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.08 11.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -97.19 88.88 4.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.875 0.369 . . . . 0.0 110.888 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 51.2 t -128.28 99.38 5.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.854 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -38.63 -61.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.108 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 61.9 mtt180 -77.31 105.18 8.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.58 -76.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 449' ' ' GLU . 32.2 tt0 -82.92 7.02 16.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -107.56 -12.03 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 18.4 t -68.63 111.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.587 0.708 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 4.47 2.19 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.672 2.248 . . . . 0.0 112.326 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -99.6 176.46 5.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.927 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 15.1 mmm -88.65 140.95 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.891 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -122.14 -74.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.505 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.39 -67.97 1.51 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.455 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.505 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.4 m-20 -29.94 -49.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.884 0.373 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.4 t80 -41.57 128.2 2.36 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.645 0.736 . . . . 0.0 110.884 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 150.01 67.59 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.67 2.247 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 52.8 t -72.23 142.29 48.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -76.83 -66.47 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 464' ' ' HIS . 33.0 mt -45.81 -57.76 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -42.48 -23.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.933 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.569 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 29.1 m-70 -99.02 -50.17 4.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.491 ' C ' ' O ' ' A' ' 464' ' ' HIS . 72.0 p -30.51 -47.84 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.118 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.9 p -127.23 -31.91 2.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.163 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.68 -34.05 2.46 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -110.46 145.33 37.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 0.0 110.902 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.0 t -106.36 118.64 37.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -50.26 -37.84 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -49.92 -50.45 46.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 106.4 -152.86 17.03 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.496 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -80.07 12.91 2.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 0.0 110.845 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -123.95 34.35 5.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 45.6 t -79.56 139.58 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.56 ' HE1' ' CE2' ' A' ' 440' ' ' TYR . 4.4 ppp? -81.1 22.46 0.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.401 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 16.0 m-85 -130.9 161.49 31.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.863 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.9 m -80.1 127.11 31.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.852 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -99.68 26.65 6.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.832 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . 0.405 ' HB2' ' HD2' ' A' ' 481' ' ' PRO . 3.1 p30 -69.68 154.86 94.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 480' ' ' ASP . 53.5 Cg_endo -69.76 120.55 7.32 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.714 2.276 . . . . 0.0 112.372 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.569 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 54.4 mt -39.79 132.06 1.76 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 69.4 p -109.45 172.24 6.97 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -49.7 -35.68 22.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' A' ' 486' ' ' THR . 9.4 tp10 -78.54 -75.33 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 485' ' ' GLU . 49.6 p -36.37 -52.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.134 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.6 OUTLIER -39.99 -47.12 2.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.09 -44.35 95.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 486' ' ' THR . 78.1 mt -48.85 -65.68 0.53 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.455 ' CD1' HD23 ' A' ' 482' ' ' LEU . 45.2 mt -40.08 -55.27 2.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -42.81 -41.67 3.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . 0.45 ' HD3' ' C ' ' A' ' 492' ' ' LYS . 7.2 tmtm? -76.9 -53.26 8.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -50.87 -58.96 4.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.847 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.87 -179.924 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.478 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 63.1 mttt . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.744 0.307 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -79.05 48.31 0.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.862 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -121.64 152.39 39.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.554 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 40.5 tp -67.52 124.0 22.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.935 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 17.1 t -57.26 127.6 32.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.04 -3.38 16.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -107.62 -44.06 4.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.45 ' CD2' ' CG ' ' A' ' 455' ' ' HIS . 30.4 t80 -51.65 -38.57 55.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.902 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.7 mt -39.58 -35.38 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.119 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.97 -31.27 11.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.133 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 112.89 -4.22 25.79 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.479 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . 0.451 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -100.33 85.91 3.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.875 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 48.6 t -121.27 102.54 8.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.867 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.14 -69.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.8 mtt85 -76.9 104.65 7.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.909 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.94 -74.55 0.32 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -81.93 21.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.944 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -128.82 -4.28 5.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 32.8 t -70.66 111.74 10.68 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.632 0.729 . . . . 0.0 110.906 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 2.39 3.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.478 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 44.4 m-85 -100.99 177.14 5.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' MET . . . . . 0.406 ' HE3' ' CB ' ' A' ' 457' ' ' ASP . 37.8 mmm -90.97 142.54 27.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.45 ' CG ' ' CD2' ' A' ' 440' ' ' TYR . 18.5 m170 -120.36 -75.77 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.46 -64.84 1.79 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.457 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -32.29 -47.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.554 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 21.6 t80 -46.16 122.59 6.43 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.727 . . . . 0.0 110.864 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 143.86 51.8 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.325 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.6 t -65.7 135.56 55.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . 0.472 ' HD3' ' CE ' ' A' ' 493' ' ' MET . 6.5 ttpt -73.44 -64.96 0.88 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 464' ' ' HIS . 44.3 mt -44.44 -58.31 3.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.401 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 28.0 t80 -39.11 -25.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' A' ' 462' ' ' LEU . 64.3 m-70 -100.67 -55.33 2.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.822 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.466 ' C ' ' O ' ' A' ' 464' ' ' HIS . 30.2 p -32.98 -39.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.2 p -128.58 -38.29 1.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.401 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 138.27 -38.26 1.71 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.523 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -111.01 155.42 22.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.856 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 23.9 t -106.52 136.09 46.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.1 tp -76.07 -25.97 17.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -56.33 -39.38 72.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 109.75 -161.11 13.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.516 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.8 -13.75 59.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.832 0.349 . . . . 0.0 110.935 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -99.98 29.62 4.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -71.96 131.37 42.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.566 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.25 34.04 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.566 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 10.7 m-85 -132.92 155.12 49.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.922 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.7 m -80.18 127.91 32.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -99.76 15.67 26.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.31 156.23 61.92 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.597 0.713 . . . . 0.0 110.864 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 119.71 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.615 2.21 . . . . 0.0 112.35 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.463 HD11 ' CD1' ' A' ' 490' ' ' LEU . 29.0 mt -39.87 147.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 82.1 p -126.27 157.86 37.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.095 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -41.91 -33.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -80.96 -76.4 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 489' ' ' LEU . 59.6 p -44.92 -48.99 11.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.165 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -38.86 -45.16 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -56.22 -41.31 75.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 486' ' ' THR . 51.9 mt -45.88 -62.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.463 ' CD1' HD11 ' A' ' 482' ' ' LEU . 81.8 mt -41.74 -56.55 2.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.958 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -42.72 -41.99 3.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -80.2 -60.01 2.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' MET . . . . . 0.472 ' CE ' ' HD3' ' A' ' 461' ' ' LYS . 13.4 tmm? -41.6 -57.4 2.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.895 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.486 ' N ' HD12 ' A' ' 494' ' ' LEU . 10.4 mp . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.509 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 18.5 mttp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.753 0.311 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -118.88 44.77 2.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -120.16 154.48 34.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.897 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 35.6 tp -70.86 129.02 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.4 t -66.0 131.63 46.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.919 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.42 2.53 9.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.933 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -114.95 -47.46 2.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.511 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 31.6 t80 -48.17 -35.2 11.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.9 mt -41.12 -33.85 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.168 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 66.6 p -99.74 -33.33 10.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.09 -9.08 13.95 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.15 98.57 9.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.378 . . . . 0.0 110.834 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.6 t -134.5 111.56 10.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.04 -62.08 0.78 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 45.6 mtt180 -85.28 111.07 19.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.93 -79.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.086 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.06 0.99 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -102.17 -5.07 24.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 9.7 t -70.38 111.92 11.07 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.59 0.71 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.659 2.239 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.509 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -100.29 -176.17 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.93 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 21.2 mmm -97.36 138.75 34.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.5 m170 -119.82 -75.39 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.43 -62.26 2.09 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.455 ' C ' ' O ' ' A' ' 456' ' ' GLY . 68.9 m-20 -34.18 -50.92 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 110.875 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -40.84 127.96 1.94 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.679 0.752 . . . . 0.0 110.886 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 140.42 42.69 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.681 2.254 . . . . 0.0 112.354 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 13.7 t -59.13 144.28 46.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.902 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 56.1 tttp -77.97 -68.84 0.59 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.86 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.483 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.8 mt -45.15 -58.09 3.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.448 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 54.9 t80 -40.25 -24.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.897 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.552 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.5 m-70 -100.17 -52.42 3.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.433 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.6 p -33.44 -41.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.149 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 38.1 p -128.37 -29.22 2.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.448 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 128.75 -38.74 1.99 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.439 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -109.83 149.08 30.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.851 0.358 . . . . 0.0 110.885 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.1 t -102.22 131.43 48.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.898 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.5 tp -77.73 -21.94 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.143 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -50.63 -48.25 58.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 132.14 -168.97 22.33 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.508 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.94 -33.81 72.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.842 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.02 64.06 0.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.0 t -73.58 153.35 40.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.895 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.535 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.9 ppp? -75.61 -20.03 58.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.535 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 18.0 m-85 -104.26 161.17 14.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.867 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 68.5 m -79.97 151.27 30.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 48.6 m170 -115.04 30.2 7.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.91 157.86 85.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.586 0.708 . . . . 0.0 110.906 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 131.27 20.8 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.713 2.275 . . . . 0.0 112.306 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.552 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 38.6 mt -56.15 149.38 16.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 485' ' ' GLU . 66.4 p -136.35 154.97 50.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.132 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.79 -29.7 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.4 mt-10 -78.94 -74.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.913 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.3 p -48.6 -50.64 31.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.108 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -48.53 2.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.852 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -52.52 -40.77 62.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 77.2 mt -53.26 -61.25 2.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.872 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.429 ' CD1' HD22 ' A' ' 482' ' ' LEU . 94.9 mt -41.87 -56.65 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -41.95 -40.61 2.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.871 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.09 -57.18 3.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.894 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.7 tmm? -48.96 -60.56 2.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 96.6 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.479 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 11.3 mttp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.715 0.293 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -121.59 42.98 2.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.867 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -116.58 151.4 36.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 37.3 tp -58.73 125.99 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.874 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 14.7 t -65.06 146.25 55.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -79.91 -10.64 59.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.88 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -104.1 -46.14 4.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.409 ' CZ ' ' HB3' ' A' ' 455' ' ' HIS . 21.9 t80 -47.43 -36.33 9.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.889 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.1 mt -42.95 -37.68 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.114 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 70.8 p -101.6 -36.69 8.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.138 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.46 -4.76 17.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 10.6 t80 -99.63 71.33 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 110.853 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.77 105.31 15.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -61.27 0.88 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.104 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -83.44 109.48 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.871 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.74 -78.58 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.125 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -81.34 -1.21 44.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -99.4 0.07 41.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 10.3 t -80.08 111.11 19.31 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.627 0.727 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 3.83 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.7 2.267 . . . . 0.0 112.336 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.479 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -99.87 179.99 4.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.0 mmm -95.16 140.54 29.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.823 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.409 ' HB3' ' CZ ' ' A' ' 440' ' ' TYR . 18.8 m170 -119.19 -76.11 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.37 -65.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.464 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.451 ' C ' ' O ' ' A' ' 456' ' ' GLY . 29.0 m-20 -33.93 -43.69 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.862 0.363 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.6 t80 -43.19 128.48 3.46 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.598 0.713 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 149.25 66.7 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.645 2.23 . . . . 0.0 112.399 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.467 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 9.2 t -74.28 150.3 40.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.89 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 16.3 ttmt -80.75 -69.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.1 mt -43.77 -60.3 1.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . 0.412 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 86.3 t80 -39.29 -25.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 13.6 m-70 -99.48 -51.67 3.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 464' ' ' HIS . 54.2 p -33.78 -38.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.0 p -131.29 -36.71 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.156 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . 0.412 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 140.3 -39.07 1.52 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.483 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . 0.438 ' CG ' ' N ' ' A' ' 469' ' ' CYS . 21.2 t-20 -107.79 168.18 9.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . 0.438 ' N ' ' CG ' ' A' ' 468' ' ' ASN . 17.7 t -120.9 150.3 41.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.3 tp -76.02 -36.49 31.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.112 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -52.6 -61.79 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 138.61 -156.64 24.26 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.99 -39.63 87.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.755 0.312 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.67 63.71 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -79.06 144.47 34.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.89 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 3.9 ppp? -55.71 -24.2 33.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.875 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 33.5 m-85 -104.28 160.14 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.884 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.4 m -80.04 145.87 32.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.898 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -111.55 22.58 14.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . 0.411 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 71.1 m-20 -58.41 156.35 22.81 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.627 0.727 . . . . 0.0 110.83 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.4 Cg_endo -69.74 112.1 2.99 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.716 2.278 . . . . 0.0 112.358 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 18.2 mt -39.72 129.37 2.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.93 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 7.2 p -102.63 -179.94 4.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.11 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . 0.445 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 0.2 OUTLIER -70.41 -30.83 67.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.445 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 12.7 pt-20 -79.0 -42.33 26.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.917 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.9 p -68.57 -50.85 48.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.132 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.38 -31.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.12 -41.38 74.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 486' ' ' THR . 49.9 mt -53.56 -66.06 0.46 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 91.8 mt -39.93 -56.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -39.69 -41.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -80.09 -42.76 22.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -59.6 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 452' ' ' PRO . 56.2 mttt . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.728 0.299 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 2.8 tpp85 -89.15 63.75 6.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -139.17 144.08 38.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.854 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.572 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 35.6 tp -61.95 132.5 53.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . 0.436 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 7.0 t -67.06 137.79 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -77.48 -7.28 55.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.91 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -109.54 -44.12 3.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.462 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 39.2 t80 -48.13 -34.66 10.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.905 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 441' ' ' ILE . 63.5 mt -43.48 -32.9 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.129 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 p -99.51 -33.8 10.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.139 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.01 -10.58 13.58 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.501 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -100.43 98.99 9.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.865 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 37.6 t -136.42 109.47 7.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.51 -59.31 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.419 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 7.8 mtm105 -80.49 107.16 13.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.18 -77.61 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -82.43 -10.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -99.45 15.61 25.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.891 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 35.8 t -80.42 111.72 25.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.1 Cg_endo -69.75 3.21 2.9 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.64 2.227 . . . . 0.0 112.368 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -105.35 -175.11 2.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 40.3 mmm -100.74 136.52 40.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.899 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.462 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 24.8 m170 -118.13 -75.24 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.74 -65.3 1.78 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.516 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 456' ' ' GLY . 8.3 m-20 -33.44 -47.26 0.21 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.826 0.346 . . . . 0.0 110.847 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.572 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 17.2 t80 -43.46 130.3 3.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.64 0.734 . . . . 0.0 110.845 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . 0.486 ' CB ' HD23 ' A' ' 482' ' ' LEU . 53.7 Cg_endo -69.81 146.25 59.34 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.685 2.257 . . . . 0.0 112.345 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.533 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 45.4 t -70.19 146.14 50.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.885 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -79.64 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 464' ' ' HIS . 35.2 mt -45.41 -59.77 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.958 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -40.91 -22.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 28.5 m-70 -100.19 -54.96 2.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.47 ' C ' ' O ' ' A' ' 464' ' ' HIS . 71.8 p -31.17 -41.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.136 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.408 ' N ' ' O ' ' A' ' 464' ' ' HIS . 77.8 p -128.75 -36.78 1.8 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.114 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 137.9 -38.07 1.75 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.476 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -106.72 174.32 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.866 0.365 . . . . 0.0 110.852 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.8 t -133.17 128.7 36.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.4 tp -72.11 -26.63 25.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -49.59 -43.52 46.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.15 -169.59 23.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.6 -29.48 51.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.773 0.321 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -100.67 44.33 1.02 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 47.7 t -51.17 144.27 9.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.513 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 5.1 ppp? -65.42 -17.35 64.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.513 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 17.8 m-85 -102.81 159.44 15.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 29.1 m -80.13 132.41 35.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -100.8 23.5 10.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.77 159.51 52.94 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.612 0.72 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 110.79 2.65 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.671 2.247 . . . . 0.0 112.332 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.486 HD23 ' CB ' ' A' ' 459' ' ' PRO . 24.9 mt -40.16 131.5 2.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.8 p -99.59 169.63 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -56.2 -30.98 63.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -81.41 -55.47 4.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.403 ' HA ' ' CD1' ' A' ' 489' ' ' LEU . 47.6 p -55.32 -37.95 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.119 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -41.84 63.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -65.28 -33.39 75.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.403 ' CD1' ' HA ' ' A' ' 486' ' ' THR . 62.9 mt -59.39 -65.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 493' ' ' MET . 40.6 mt -40.13 -61.57 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -39.95 -41.91 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -79.94 -31.02 40.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' MET . . . . . 0.467 ' N ' ' O ' ' A' ' 490' ' ' LEU . 14.0 tmm? -63.32 -59.4 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.886 -179.964 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.778 0.323 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . 0.468 ' HB2' ' CD2' ' A' ' 489' ' ' LEU . 0.0 OUTLIER -83.08 35.12 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -115.37 154.59 28.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 52.4 tp -65.04 117.78 8.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.921 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . 0.461 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.1 t -50.66 116.99 2.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -60.23 -11.51 6.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -100.54 -48.68 4.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.49 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 42.3 t80 -47.09 -36.55 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 64.6 mt -40.05 -35.31 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.157 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 20.2 p -100.4 -33.45 10.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.56 -8.68 15.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.508 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.01 94.1 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 4.5 t -132.68 106.91 8.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.21 -67.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 25.0 mtm-85 -67.07 101.62 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.51 -75.11 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.072 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -81.34 -6.62 59.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -112.6 23.54 13.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.0 t -73.95 114.77 35.93 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.609 0.719 . . . . 0.0 110.925 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -5.92 17.36 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.68 2.254 . . . . 0.0 112.358 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -106.59 -173.54 2.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.1 mmm -99.63 148.55 24.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.916 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . 0.49 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 23.9 m170 -126.3 -76.68 0.58 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.837 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' N ' ' A' ' 458' ' ' PHE . . . -80.91 -65.28 1.72 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.475 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.2 m-20 -33.98 -35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 456' ' ' GLY . 16.3 t80 -56.79 124.9 66.57 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.665 0.745 . . . . 0.0 110.836 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 135.08 29.66 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 2.271 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 7.4 t -57.68 147.74 26.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.837 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -80.27 -68.16 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 464' ' ' HIS . 25.6 mt -45.52 -58.19 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.929 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -41.22 -23.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.4 m-70 -99.91 -51.41 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 80.8 p -33.11 -48.14 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 50.5 p -123.36 -32.32 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.167 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.22 -38.57 1.84 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.479 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -105.58 156.96 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.889 0.376 . . . . 0.0 110.873 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 11.4 t -117.3 130.82 56.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.872 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.8 tp -57.21 -29.3 31.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.143 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -56.75 -63.53 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.23 -148.26 19.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.501 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -76.31 -38.44 56.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.803 0.335 . . . . 0.0 110.827 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -100.4 63.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 51.9 t -78.86 147.61 33.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.4 ppp? -59.43 -23.59 62.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 25.0 m-85 -103.53 161.29 14.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 59.2 m -80.24 141.07 35.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.833 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 47.3 m170 -108.89 29.34 7.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.34 152.86 93.78 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.642 0.734 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.81 116.37 4.53 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 0.0 112.33 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 40.2 mt -40.06 147.54 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.2 p -129.74 155.46 45.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.11 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . 0.411 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 3.5 pm0 -39.38 -31.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . 0.411 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 6.0 tm-20 -80.36 -73.99 0.33 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.429 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.7 p -47.61 -49.61 26.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.151 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -43.5 1.39 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -59.71 -41.82 91.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.468 ' CD2' ' HB2' ' A' ' 434' ' ' ARG . 31.5 mt -51.08 -64.79 0.7 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 493' ' ' MET . 44.6 mt -40.62 -59.45 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -39.08 -37.31 0.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -38.91 30.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.925 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' MET . . . . . 0.437 ' N ' ' O ' ' A' ' 490' ' ' LEU . 12.1 tmm? -62.8 -58.75 6.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.825 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.92 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 433' ' ' LYS . . . . . 0.448 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 17.0 mttm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.786 0.327 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 38.5 mmm-85 -109.17 39.49 2.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -112.25 151.09 30.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 436' ' ' LEU . . . . . 0.466 HD12 ' CD2' ' A' ' 458' ' ' PHE . 14.8 tp -63.77 124.12 20.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.926 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 37.8 t -67.75 139.47 56.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -79.57 4.75 14.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -109.12 -53.61 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.878 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' TYR . . . . . 0.463 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 22.1 t80 -46.89 -39.99 13.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 53.4 mt -40.54 -37.98 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.097 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.7 p -101.7 -35.94 8.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.156 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.02 -9.96 13.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -99.06 87.62 3.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.892 0.377 . . . . 0.0 110.886 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.4 t -125.01 103.6 8.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.71 -59.08 1.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.174 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 447' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.7 mtt180 -81.98 107.52 14.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -79.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -82.6 8.5 11.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -108.34 -12.67 15.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 451' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 14.6 t -65.77 111.26 5.92 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.615 0.722 . . . . 0.0 110.893 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 2.99 3.05 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.64 2.227 . . . . 0.0 112.342 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 453' ' ' TYR . . . . . 0.448 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 80.3 m-85 -100.1 176.1 5.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 32.1 mmm -91.86 140.66 29.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.866 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -117.81 -77.25 0.57 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.464 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.84 -66.98 1.58 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' A' ' 456' ' ' GLY . 25.2 m-20 -32.58 -43.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . 0.466 ' CD2' HD12 ' A' ' 436' ' ' LEU . 19.2 t80 -45.52 130.31 6.33 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.626 0.727 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 144.3 53.79 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 0.0 112.322 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' CYS . . . . . 0.492 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 20.1 t -65.71 141.95 58.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -75.91 -66.74 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.0 mt -44.67 -58.64 2.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -39.37 -25.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' HIS . . . . . 0.544 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 48.2 m-70 -100.58 -53.14 3.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' THR . . . . . 0.474 ' C ' ' O ' ' A' ' 464' ' ' HIS . 56.0 p -31.38 -42.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.149 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 46.5 p -129.49 -32.92 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.149 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.95 -41.35 1.5 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.49 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -103.72 150.47 24.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.922 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 471' ' ' ASN . 53.3 t -110.69 99.9 8.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.87 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' ILE . . . . . 0.425 ' O ' ' CG2' ' A' ' 470' ' ' ILE . 8.1 tp -80.51 38.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 469' ' ' CYS . 30.2 m-20 -95.76 -54.73 3.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 170.11 154.32 9.3 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -47.42 -47.54 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.819 0.342 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -100.92 55.53 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -42.06 152.51 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' MET . . . . . 0.473 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 4.2 ppp? -77.31 -18.39 57.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.855 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.473 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.7 m-85 -105.72 158.93 16.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.862 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 67.5 m -80.1 144.81 32.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.852 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -108.12 31.87 5.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.75 158.07 81.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.602 0.715 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 134.49 28.12 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.688 2.259 . . . . 0.0 112.377 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.544 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 44.7 mt -62.13 137.03 58.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 69.1 p -119.9 152.55 37.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.125 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -40.03 -29.23 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.71 -75.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.838 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.45 ' O ' ' N ' ' A' ' 489' ' ' LEU . 48.6 p -46.9 -47.96 21.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.116 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' ARG . . . . . 0.405 ' N ' ' HG1' ' A' ' 486' ' ' THR . 4.4 tpt180 -40.34 -41.09 1.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -64.18 -39.27 93.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.946 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 486' ' ' THR . 79.1 mt -48.08 -67.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.87 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 60.7 mt -41.26 -57.18 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -39.96 -42.44 1.36 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.88 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -79.79 -44.61 20.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.882 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.4 tmm? -54.89 -59.29 4.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.869 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' LEU . . . . . 0.407 ' N ' HD12 ' A' ' 494' ' ' LEU . 9.9 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 32.6 p -125.47 -44.56 1.84 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.888 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 51.3 p -66.22 -62.39 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.86 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 80.55 -46.09 3.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.515 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 18.1 t -58.93 156.27 11.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.359 . . . . 0.0 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' SER . . . . . 0.404 ' O ' ' C ' ' A' ' 428' ' ' GLY . 52.9 p -146.49 111.28 5.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.822 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 427' ' ' SER . . . -36.23 141.12 0.21 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.499 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -79.26 106.41 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 3.6 mp -138.77 160.08 64.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.638 0.732 . . . . 0.0 110.913 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 80.38 0.9 Allowed 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.655 2.236 . . . . 0.0 112.306 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 30.6 mmtm -146.66 125.01 12.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 18.4 mmtp -84.6 120.18 26.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.15 43.01 1.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.86 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 436' ' ' LEU . 51.3 tp10 -114.52 162.54 16.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.916 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 435' ' ' GLU . 26.4 tp -74.65 104.72 5.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 34.9 t -42.41 135.3 2.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.462 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -71.1 -5.6 32.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.925 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -105.48 -49.4 3.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.564 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 40.6 t80 -43.27 -35.42 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -44.11 -39.1 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 58.6 p -100.32 -37.78 8.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.04 -4.52 18.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . 0.476 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -99.54 77.65 2.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.23 107.37 15.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.888 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.41 -59.0 1.41 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.102 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -84.77 111.12 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.14 -76.85 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.062 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -81.56 -5.21 57.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -99.4 6.83 45.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.869 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 44.8 t -80.09 111.41 21.79 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 1.5 4.34 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.692 2.261 . . . . 0.0 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -102.05 179.6 4.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 18.9 mmm -95.48 143.32 26.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.93 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.564 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 21.9 m170 -120.51 -77.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.18 -63.2 1.9 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.52 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.8 m-20 -34.0 -46.65 0.24 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.789 0.328 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -43.17 129.36 3.42 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.591 0.71 . . . . 0.0 110.907 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 146.03 59.04 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.3 t -69.01 145.28 53.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.88 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 29.4 tttp -80.09 -65.6 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.867 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.1 mt -44.73 -58.64 2.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -39.61 -25.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.49 ' N ' ' O ' ' A' ' 462' ' ' LEU . 43.8 m-70 -100.29 -52.46 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.855 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 464' ' ' HIS . 70.7 p -31.61 -45.31 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.15 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 76.7 p -126.01 -34.66 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.89 -37.69 1.98 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.499 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -108.58 140.73 41.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 110.866 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.3 t -100.55 135.18 42.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.6 tp -61.2 -42.03 91.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.156 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 -51.84 -57.48 9.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 116.12 -149.0 18.88 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -75.76 -16.03 60.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 110.866 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.18 44.41 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.832 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 t -79.48 147.96 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.572 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.3 ppp? -76.14 -11.15 59.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.572 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.3 m-85 -107.96 160.19 15.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 74.8 m -77.77 143.48 37.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -114.73 31.79 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.841 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -72.87 159.43 85.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.606 0.717 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 120.86 7.58 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.687 2.258 . . . . 0.0 112.37 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.425 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 27.1 mt -42.99 148.51 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.7 p -131.11 154.77 47.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.156 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -39.95 -31.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -80.01 -74.13 0.32 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 70.1 p -42.83 -46.33 5.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.18 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.16 -46.5 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -55.9 -38.33 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.837 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 34.7 mt -53.03 -65.86 0.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.921 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 84.3 mt -40.64 -56.6 2.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -39.95 -43.36 1.51 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.15 -59.94 2.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -41.41 -59.4 1.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.868 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.81 -62.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -40.47 -45.07 2.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -62.27 -58.52 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.87 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.47 -64.81 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.861 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -39.41 -62.81 0.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -52.04 -54.03 34.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -87.59 89.45 8.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -112.47 141.0 16.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.436 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -112.51 146.46 38.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.741 0.305 . . . . 0.0 111.118 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -77.31 143.62 38.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.883 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -143.53 127.25 17.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.839 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -49.04 160.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -165.94 154.08 10.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -167.9 174.63 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.897 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 96.3 t -104.28 102.5 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.131 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -49.6 145.22 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -73.27 131.04 41.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.31 -43.88 69.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -169.33 107.58 0.41 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -82.52 147.01 28.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.924 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 86.6 p -54.58 143.73 23.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.847 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -130.37 152.93 19.94 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.482 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -173.46 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.688 2.258 . . . . 0.0 112.351 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.2 t -116.83 160.66 20.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.68 133.26 30.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 119.072 -0.849 . . . . 0.0 112.523 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . 0.436 ' O ' ' C ' ' A' ' 423' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 422' ' ' GLY . 28.4 t -34.88 136.89 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.857 0.361 . . . . 0.0 110.825 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 2.7 t -108.31 150.6 27.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -83.34 -170.81 46.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.506 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 14.5 m -150.65 122.92 8.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.877 0.37 . . . . 0.0 110.799 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 1.9 t -98.78 -38.32 9.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 42.53 -111.75 0.38 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.507 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -49.33 146.06 4.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.9 0.381 . . . . 0.0 110.876 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.0 mp -114.14 144.46 31.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.562 0.696 . . . . 0.0 110.939 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.77 -91.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.707 2.272 . . . . 0.0 112.368 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -103.97 163.25 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.442 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 24.2 mttm -72.22 163.09 28.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.916 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.472 ' HB3' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -120.53 48.34 1.62 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -139.47 154.66 47.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.513 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 14.5 tp -70.16 143.26 52.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 22.6 t -74.11 146.69 43.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.892 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.476 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.2 OUTLIER -77.35 -12.5 59.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.912 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -104.49 -48.36 3.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.515 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 37.7 t80 -42.94 -36.38 1.52 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.941 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.2 mt -40.1 -36.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.76 -34.68 10.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.96 -9.03 21.25 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -98.86 81.93 2.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.821 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.1 t -118.26 100.32 7.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.06 -59.61 1.43 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.103 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -74.46 96.19 2.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.18 -76.34 0.23 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.145 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.56 20.3 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -124.98 -1.32 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.2 t -80.16 111.24 20.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.644 0.735 . . . . 0.0 110.925 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 0.26 5.88 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.664 2.243 . . . . 0.0 112.348 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.442 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 78.5 m-85 -100.01 175.69 5.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 48.8 mmm -90.09 143.34 26.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.898 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.515 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 22.2 m170 -120.03 -75.85 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.28 -68.15 1.5 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.467 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.452 ' C ' ' O ' ' A' ' 456' ' ' GLY . 5.9 m-20 -34.5 -35.53 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.844 0.354 . . . . 0.0 110.862 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.513 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 20.7 t80 -51.81 124.05 26.45 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.663 0.744 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 140.99 43.87 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.721 2.281 . . . . 0.0 112.291 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.36 142.12 55.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -76.81 -65.59 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.885 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.9 mt -44.99 -58.25 3.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -40.72 -23.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.56 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.9 m-70 -100.37 -51.49 3.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.878 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.464 ' C ' ' O ' ' A' ' 464' ' ' HIS . 49.0 p -31.37 -40.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 464' ' ' HIS . 75.6 p -132.93 -32.75 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.53 -34.81 2.3 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -110.0 149.21 30.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 15.0 t -104.24 151.43 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.1 tp -79.33 -37.13 18.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.112 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -49.89 -65.94 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 139.67 -169.39 24.64 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.527 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.19 -24.54 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.35 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -104.9 46.92 0.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.75 147.62 47.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.528 ' SD ' ' CE1' ' A' ' 477' ' ' PHE . 5.2 ppp? -79.67 11.74 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.851 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.528 ' CE1' ' SD ' ' A' ' 476' ' ' MET . 14.0 m-85 -123.07 155.71 36.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 8.0 m -75.36 127.09 32.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -103.03 16.12 27.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.03 156.44 74.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.647 0.737 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 121.26 7.94 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.687 2.258 . . . . 0.0 112.342 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.56 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 59.3 mt -41.49 144.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.921 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 485' ' ' GLU . 4.4 p -138.11 158.12 44.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.162 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -38.69 -29.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 483' ' ' THR . 32.4 mt-10 -81.24 -75.77 0.27 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 489' ' ' LEU . 68.1 p -50.03 -47.52 53.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.139 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.09 -36.5 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -65.21 -41.61 94.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' A' ' 486' ' ' THR . 87.8 mt -46.9 -62.61 1.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 66.4 mt -40.32 -57.12 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -42.54 -38.24 1.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.853 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.98 -52.37 8.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.5 -60.83 2.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 8.0 mp -49.84 -47.43 51.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.932 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.05 -45.08 31.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.128 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.63 -47.58 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 498' ' ' ALA . 26.3 t0 -73.04 -68.09 0.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -37.56 -41.77 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.087 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -52.26 -60.7 2.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.892 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -42.79 -48.72 5.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 123.58 121.85 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.482 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -139.24 117.53 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.763 0.316 . . . . 0.0 111.115 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -104.58 86.76 2.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.813 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -127.94 92.6 3.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -108.84 147.36 32.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -109.27 174.55 5.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -122.15 144.66 48.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.895 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 99.8 t -99.2 114.97 38.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.19 112.91 24.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.889 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.16 147.56 16.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 512' ' ' LYS . 14.9 mt -97.72 78.26 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.941 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 511' ' ' LEU . 63.7 mttt 34.95 41.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.883 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.25 147.36 0.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 2.4 m -172.71 159.21 4.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -116.88 64.04 0.36 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.504 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 173.23 11.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.69 2.26 . . . . 0.0 112.376 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.5 m -169.32 128.62 1.02 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 19.1 m -131.43 163.51 27.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.85 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.477 -179.984 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 18.8 m -39.57 117.65 0.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.896 0.379 . . . . 0.0 110.825 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 29.8 p -150.31 166.1 31.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.823 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 139.19 96.45 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.486 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 43.6 t -58.68 154.83 13.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.901 0.381 . . . . 0.0 110.811 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 19.7 m -156.88 146.96 21.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -165.51 129.06 1.88 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -87.86 145.62 25.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 0.0 110.914 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 9.0 mt -137.21 151.46 71.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 0.0 110.898 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -2.43 10.17 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.653 2.235 . . . . 0.0 112.304 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -111.09 158.24 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.882 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -131.09 131.48 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -105.53 44.67 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -113.71 152.17 30.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.897 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.412 HD11 ' CD2' ' A' ' 458' ' ' PHE . 37.4 tp -63.12 114.63 3.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.976 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.71 131.99 52.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.91 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 15.47 1.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.41 -37.11 3.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.508 ' CZ ' ' HE2' ' A' ' 476' ' ' MET . 34.9 t80 -68.09 -35.9 78.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.88 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.0 mt -43.19 -33.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.5 p -102.08 -36.47 8.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 120.09 -10.15 11.05 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . 0.418 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 8.2 t80 -99.65 85.86 3.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.871 0.367 . . . . 0.0 110.913 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.1 t -121.16 110.49 16.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.56 -70.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.095 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -78.59 107.73 11.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.844 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -75.32 0.26 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.7 2.99 23.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -114.35 15.78 17.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 36.8 t -80.59 111.2 20.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.646 0.736 . . . . 0.0 110.864 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.7 -0.88 7.5 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.694 2.263 . . . . 0.0 112.367 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -101.88 179.76 4.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 34.4 mmm -99.98 139.29 35.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.418 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 26.2 m170 -113.17 -78.34 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.13 -63.12 1.91 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.507 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 42.6 t0 -32.71 -45.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.828 0.346 . . . . 0.0 110.926 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.412 ' CD2' HD11 ' A' ' 436' ' ' LEU . 17.0 t80 -46.91 124.59 8.15 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.608 0.718 . . . . 0.0 110.892 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 145.95 58.82 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.704 2.269 . . . . 0.0 112.333 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.475 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.5 t -64.48 144.41 57.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.843 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -79.33 -67.15 0.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.1 mt -44.63 -59.17 2.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -39.67 -25.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.546 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 34.8 m-70 -99.89 -51.72 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.442 ' HG1' ' N ' ' A' ' 466' ' ' THR . 44.5 p -35.58 -44.38 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.195 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.442 ' N ' ' HG1' ' A' ' 465' ' ' THR . 68.3 p -123.35 -35.03 3.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.37 -37.65 1.96 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.489 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -109.96 147.74 32.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.86 0.362 . . . . 0.0 110.855 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 38.2 t -103.2 147.56 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.879 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 4.5 tp -70.6 -42.36 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -51.91 -54.71 26.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 121.63 -153.24 16.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.434 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.44 -19.15 59.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.321 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -101.41 42.7 1.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.95 143.61 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.508 ' HE2' ' CZ ' ' A' ' 440' ' ' TYR . 5.3 ppp? -80.93 19.32 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.415 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 26.3 m-85 -126.38 158.61 35.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.882 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 13.2 m -76.47 120.29 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -100.84 32.66 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.821 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -77.71 161.51 71.45 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.588 0.709 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 116.93 4.79 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.712 2.275 . . . . 0.0 112.311 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.546 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 28.6 mt -40.98 150.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.2 p -133.27 154.92 50.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.154 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -40.48 -33.26 0.25 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -80.16 -74.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.439 ' HA ' ' CD1' ' A' ' 489' ' ' LEU . 32.1 p -46.95 -52.98 13.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.96 -44.55 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -59.64 -38.29 80.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.439 ' CD1' ' HA ' ' A' ' 486' ' ' THR . 55.0 mt -52.21 -65.54 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.936 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.424 ' CD1' HD22 ' A' ' 482' ' ' LEU . 78.1 mt -42.25 -57.59 2.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -39.89 -42.31 1.31 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -79.53 -48.32 14.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.913 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -51.5 -58.76 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 97.2 mt -40.98 -47.95 3.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.925 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.67 -43.36 93.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.099 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -60.26 -43.73 95.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -63.31 -63.96 1.04 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -50.18 -56.27 11.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.102 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -49.0 -57.95 5.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.902 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.37 -52.36 28.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 99.04 -83.49 0.61 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.426 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -135.67 175.35 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.766 0.317 . . . . 0.0 111.085 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -56.38 146.38 24.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -140.69 155.67 46.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.827 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -64.0 129.39 39.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -119.99 -45.77 2.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.888 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -129.42 92.08 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.869 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.65 13.95 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -140.15 134.09 30.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -96.89 166.64 11.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.884 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.416 ' C ' HD12 ' A' ' 511' ' ' LEU . 4.1 pp -122.95 -42.18 2.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.91 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.411 ' N ' HD12 ' A' ' 511' ' ' LEU . 38.2 pttt -85.04 43.37 1.0 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.882 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 105.05 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.965 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 47.8 t -76.71 129.39 36.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -133.78 -163.18 10.29 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.505 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 163.9 36.6 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.332 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 56.5 p -126.78 38.0 4.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.88 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 87.6 p -58.46 170.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.827 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 CA-C-O 119.118 -0.823 . . . . 0.0 112.514 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 2.3 m -112.2 131.19 55.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.891 0.377 . . . . 0.0 110.885 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 34.9 p -58.28 175.32 0.23 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.831 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -128.45 166.58 20.94 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.505 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 59.2 p -132.31 153.58 50.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 110.852 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 71.3 m -97.35 -58.05 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.84 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 48.98 69.2 1.05 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.49 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -108.68 138.97 44.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.847 0.356 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.47 156.8 40.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.591 0.71 . . . . 0.0 110.958 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.65 2.57 3.35 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.35 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -94.0 128.66 40.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp -85.97 152.02 23.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.864 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -123.62 46.21 2.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -114.45 165.72 12.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.555 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 27.2 tp -71.71 115.92 11.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.54 125.22 22.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -66.26 -3.76 6.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -100.08 -55.36 2.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.557 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 10.2 t80 -43.91 -36.36 2.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 39.5 mt -43.74 -38.44 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -35.02 9.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.53 -9.78 11.64 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -99.73 96.16 7.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.891 0.377 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 36.5 t -130.64 102.16 6.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.095 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -67.69 82.71 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -78.73 -57.47 3.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.058 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.88 -2.03 31.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.956 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 36.0 m-20 -134.85 37.49 3.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 53.2 t -80.76 111.04 19.87 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 110.896 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.71 -2.5 10.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.712 2.275 . . . . 0.0 112.342 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -108.31 -177.24 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.893 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 38.3 mmm -100.26 147.78 25.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.557 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 23.4 m170 -122.57 -77.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.438 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.68 -65.73 1.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.488 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.4 m-20 -34.73 -39.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.555 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.7 t80 -50.44 124.59 18.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 0.0 110.826 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 141.08 44.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.339 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.0 t -65.9 141.07 58.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -78.01 -66.8 0.8 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.884 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.1 mt -45.37 -56.67 4.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -40.81 -24.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.495 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 40.9 m-70 -100.61 -53.66 3.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.862 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 464' ' ' HIS . 69.8 p -31.1 -41.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.15 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.431 ' N ' ' O ' ' A' ' 464' ' ' HIS . 39.2 p -129.81 -36.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 136.22 -37.85 1.84 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -106.66 142.74 35.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -100.51 144.45 29.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.6 tp -71.9 -36.57 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.149 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -52.21 -60.03 3.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.921 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 125.72 -156.01 19.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.512 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -71.97 -27.59 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 110.89 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -101.47 44.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -73.91 146.48 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.1 ppp? -80.6 17.52 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 25.4 m-85 -128.23 154.81 45.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.9 m -78.55 126.9 31.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -100.11 19.2 16.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.86 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.28 155.14 58.89 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.596 0.712 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 116.17 4.43 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.74 2.293 . . . . 0.0 112.324 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.495 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 12.7 mt -40.61 132.41 2.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' THR . . . . . 0.52 ' O ' ' CB ' ' A' ' 487' ' ' ARG . 69.2 p -112.71 167.13 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -49.61 -31.86 11.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -81.26 -77.0 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.885 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 49.9 p -45.62 -36.94 5.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.152 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 483' ' ' THR . 12.5 tpt180 -48.71 -40.92 30.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.859 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -61.45 -45.76 92.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 45.1 mt -41.41 -67.01 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.454 ' CD1' HD13 ' A' ' 482' ' ' LEU . 77.4 mt -40.78 -59.41 1.41 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -39.7 -41.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.87 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -79.63 -50.58 10.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.3 tmm? -57.93 -62.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 495' ' ' ALA . 80.7 mt -45.27 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.926 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' A' ' 494' ' ' LEU . . . -36.36 -46.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.096 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -58.7 -53.02 63.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.406 ' O ' ' C ' ' A' ' 498' ' ' ALA . 4.9 t0 -64.1 -65.87 0.62 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' A' ' 501' ' ' GLY . . . -37.47 -64.98 0.34 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 498' ' ' ALA . 10.4 tm-20 -36.08 -53.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -84.3 40.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 498' ' ' ALA . . . 139.96 100.92 0.47 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.494 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -161.18 126.06 3.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.737 0.303 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.66 87.18 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -87.12 171.17 10.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.837 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . 0.426 ' O ' ' C ' ' A' ' 506' ' ' LYS . 11.1 tp10 -129.52 143.38 50.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 505' ' ' GLU . 6.3 ptpp? -34.9 148.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -85.5 159.65 19.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 9.1 p -117.85 113.74 43.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.114 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -101.39 177.63 4.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -84.94 -75.5 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.3 mp 46.34 33.97 2.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.928 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 46.5 mmtt -131.94 10.64 4.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 49.8 tttt -56.73 132.23 51.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 25.4 m -150.72 176.97 10.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -177.49 83.56 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.457 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -179.08 2.66 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.696 2.264 . . . . 0.0 112.324 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 80.2 p -126.07 175.55 7.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.841 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 40.6 m -117.1 -57.22 2.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.865 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 CA-C-O 119.18 -0.789 . . . . 0.0 112.498 -179.967 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 16.3 m -138.6 142.98 39.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 110.821 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 7.4 t -166.65 110.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 160.19 51.21 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 81.3 p -84.79 137.21 33.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.885 0.374 . . . . 0.0 110.887 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 79.3 p -57.88 -45.55 86.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.877 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 172.77 178.88 43.14 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.513 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -125.39 97.09 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.902 0.382 . . . . 0.0 110.903 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -89.04 153.86 49.35 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.597 0.713 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 82.5 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.676 2.251 . . . . 0.0 112.371 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -144.87 163.78 33.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.499 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 3.7 mmmp? -88.55 -36.73 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.901 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.43 ' O ' ' CD2' ' A' ' 489' ' ' LEU . 5.7 tpt180 61.01 40.98 14.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -135.12 160.86 37.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.558 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 43.6 tp -60.75 112.92 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . 0.486 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 5.9 t -53.24 115.49 1.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -56.03 -12.18 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -101.0 -48.46 4.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.486 ' CB ' ' HB3' ' A' ' 437' ' ' CYS . 25.1 t80 -45.38 -40.75 8.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 54.1 mt -39.95 -31.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.116 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 81.7 p -102.15 -36.6 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.44 11.68 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.487 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -96.96 88.53 4.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.907 0.384 . . . . 0.0 110.848 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 12.6 t -126.37 110.49 13.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.76 -72.05 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.067 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 64.5 mtt180 -73.63 102.41 3.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.1 -72.14 0.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.112 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -76.43 -7.33 54.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.892 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . 0.41 ' OD1' ' N ' ' A' ' 450' ' ' ASN . 0.5 OUTLIER -118.93 30.26 7.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.892 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 44.7 t -73.97 113.39 22.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.725 . . . . 0.0 110.865 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.77 7.11 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.26 . . . . 0.0 112.361 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.499 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 49.3 m-85 -118.38 -175.23 2.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 27.4 mmm -101.15 134.85 43.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.5 m170 -113.58 -76.66 0.58 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.829 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.499 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -77.97 -70.64 1.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.499 ' C ' ' O ' ' A' ' 456' ' ' GLY . 2.6 m-20 -29.54 -42.84 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 0.0 110.862 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.558 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 17.9 t80 -48.16 125.84 11.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.668 0.747 . . . . 0.0 110.866 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 126.99 13.97 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.38 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.7 t -49.88 149.42 2.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -80.11 -67.9 0.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.504 ' O ' ' N ' ' A' ' 464' ' ' HIS . 48.0 mt -43.78 -60.42 1.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.422 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 92.4 t80 -39.22 -25.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.549 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.4 m-70 -99.0 -53.23 3.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 73.4 p -32.61 -43.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.142 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 82.7 p -127.37 -35.92 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.153 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.422 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.02 -40.42 1.45 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -105.04 172.65 6.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.3 t -129.56 119.18 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.905 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -51.94 -30.27 12.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -50.45 -63.35 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 143.57 -162.44 27.67 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.528 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.1 -37.6 75.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.864 0.364 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -99.88 65.14 1.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.887 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 20.9 t -78.18 151.88 32.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.8 ppp? -69.86 -19.41 63.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 20.5 m-85 -101.46 155.99 17.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 35.1 m -78.66 142.92 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.853 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -115.18 35.15 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.22 161.17 80.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.596 0.712 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 116.5 4.59 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.645 2.23 . . . . 0.0 112.348 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.549 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.0 mt -40.53 146.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.914 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 77.3 p -125.26 156.25 38.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.126 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -40.42 -33.57 0.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -80.46 -75.21 0.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 20.3 p -41.17 -49.52 3.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.18 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -46.92 2.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.97 -45.98 91.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.43 ' CD2' ' O ' ' A' ' 434' ' ' ARG . 80.7 mt -45.4 -62.24 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.946 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.418 ' CD1' HD21 ' A' ' 482' ' ' LEU . 38.8 mt -41.86 -61.31 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.906 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.8 -47.6 2.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -68.4 -43.47 77.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' MET . . . . . 0.406 ' CE ' HD23 ' A' ' 494' ' ' LEU . 14.5 tmm? -56.92 -60.34 3.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.417 HD23 ' N ' ' A' ' 494' ' ' LEU . 4.0 mm? -54.39 -36.95 64.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -57.07 -41.76 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -50.91 -46.09 60.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.832 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -77.07 -56.0 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.846 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -45.15 -51.94 9.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -55.09 -53.16 59.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -39.12 -47.36 1.55 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.097 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -65.56 -90.21 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.435 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -104.76 175.61 5.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.766 0.317 . . . . 0.0 111.083 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -109.71 147.85 32.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -157.71 165.44 35.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -118.52 127.62 53.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -108.1 159.75 16.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.88 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -157.05 141.72 16.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.882 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 508' ' ' VAL . 3.6 p -126.62 82.54 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.095 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.87 151.54 46.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -98.0 166.9 11.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.86 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 4.1 mp -98.71 -67.54 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.935 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -129.3 80.28 1.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.87 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -96.46 81.11 3.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 74.2 p -172.84 169.39 4.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -171.5 96.52 0.11 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.495 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 179.04 3.98 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.72 2.28 . . . . 0.0 112.321 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 26.3 p -156.59 174.94 14.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 75.2 p -166.17 174.4 9.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 CA-C-O 119.144 -0.809 . . . . 0.0 112.476 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 112.469 -0.253 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 15.8 m -141.98 118.0 10.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 36.8 t -174.99 144.38 0.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -159.91 38.88 0.46 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 5.7 m -102.84 40.7 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.851 0.357 . . . . 0.0 110.858 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 71.6 m -80.02 123.61 27.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 88.64 156.36 31.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.484 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -48.64 143.16 5.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . 0.453 ' CD1' ' N ' ' A' ' 430' ' ' LEU . 0.0 OUTLIER -128.44 156.59 76.76 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.555 0.693 . . . . 0.0 110.91 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -91.12 0.01 OUTLIER 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -45.29 120.2 2.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.456 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 26.2 mmmt -83.49 -32.59 25.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.459 ' CG ' HD22 ' A' ' 489' ' ' LEU . 16.7 tpp180 60.64 35.74 19.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -128.02 176.31 7.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.568 HD13 ' CD2' ' A' ' 458' ' ' PHE . 33.8 tp -75.39 121.87 22.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.962 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . 0.441 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.2 t -59.82 131.38 50.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.889 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 2.05 7.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -119.0 -40.56 2.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.455 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 34.5 t80 -54.46 -28.37 43.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.8 mt -45.57 -32.4 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 p -102.31 -29.7 11.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.19 -10.33 17.57 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.497 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -99.98 97.95 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.848 0.356 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 11.6 t -131.63 108.01 9.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.896 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.65 -66.19 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.096 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.445 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 19.2 mtm-85 -71.19 104.89 3.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.861 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -77.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -81.7 -2.79 51.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -114.11 24.6 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.3 t -80.18 114.54 47.72 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.873 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.68 3.34 Favored 'Trans proline' 0 C--O 1.231 0.13 0 C-N-CA 122.675 2.25 . . . . 0.0 112.369 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.456 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 75.6 m-85 -115.53 -174.37 2.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 31.8 mmm -100.03 150.19 22.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.877 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.455 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 30.3 m170 -125.65 -77.21 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -81.13 -60.09 2.32 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.465 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -39.32 -43.46 1.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.568 ' CD2' HD13 ' A' ' 436' ' ' LEU . 20.3 t80 -46.61 127.7 8.21 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.662 0.744 . . . . 0.0 110.903 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 140.27 42.14 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.7 146.34 49.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 34.4 tttp -80.14 -68.72 0.65 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.902 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.7 mt -44.89 -56.85 4.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.443 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 44.7 t80 -40.0 -27.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.557 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 32.5 m-70 -98.63 -52.69 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.422 ' C ' ' O ' ' A' ' 464' ' ' HIS . 31.9 p -34.21 -35.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 464' ' ' HIS . 76.8 p -132.74 -39.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.124 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.443 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.82 -38.99 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.501 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -109.14 152.16 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.859 0.362 . . . . 0.0 110.895 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 37.9 t -105.35 141.44 36.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.1 tp -72.91 -31.94 37.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -50.83 -68.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 144.45 -157.19 27.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.51 -29.06 61.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.779 0.323 . . . . 0.0 110.864 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.51 53.91 0.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.2 t -73.61 148.47 42.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.487 ' SD ' ' CZ ' ' A' ' 477' ' ' PHE . 4.4 ppp? -79.3 11.05 3.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.881 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.487 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 12.6 m-85 -124.59 158.1 33.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 2.8 m -76.8 134.02 39.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -109.33 20.27 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.826 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.79 158.92 81.63 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.601 0.715 . . . . 0.0 110.86 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 117.85 5.33 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.672 2.248 . . . . 0.0 112.374 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.557 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 88.8 mt -39.29 140.1 0.46 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 12.1 p -120.44 154.56 35.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -41.1 -29.12 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -79.97 -75.56 0.25 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.89 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.2 p -46.25 -47.88 18.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.121 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -39.68 -39.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.25 -38.91 91.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.479 ' N ' ' O ' ' A' ' 486' ' ' THR . 84.2 mt -50.44 -61.66 2.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 57.1 mt -41.43 -55.72 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -39.71 -45.37 1.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.861 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.17 -36.87 39.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -65.27 -66.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 16.2 mt -40.07 -49.02 2.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.65 97.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.36 -48.26 79.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.845 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -64.92 -69.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -43.4 -49.1 7.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.087 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.59 -58.36 7.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -85.0 96.58 9.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.09 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -100.51 40.83 2.3 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -150.96 123.7 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.087 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.25 107.32 5.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -44.58 164.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -120.06 176.03 5.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -118.9 161.0 20.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . 0.445 ' HG2' ' N ' ' A' ' 508' ' ' VAL . 23.0 tt0 -127.57 149.97 49.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.873 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . 0.445 ' N ' ' HG2' ' A' ' 507' ' ' GLU . 2.7 p -92.34 121.62 43.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.161 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -92.56 140.62 29.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -46.0 154.44 0.24 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' A' ' 512' ' ' LYS . 54.0 mt -90.48 47.96 1.49 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER 35.66 39.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.02 122.97 4.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 89.1 p -165.45 171.39 13.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.871 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 145.32 89.69 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.512 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -176.54 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.65 2.233 . . . . 0.0 112.361 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 49.1 m -107.22 168.34 9.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 35.6 t -135.06 162.26 32.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.856 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 CA-C-O 119.152 -0.804 . . . . 0.0 112.49 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 43.4 t -49.41 -43.22 44.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.847 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 67.0 m -77.27 154.68 32.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.873 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 121.46 82.96 0.69 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.493 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 8.0 m -133.47 141.82 47.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.902 0.382 . . . . 0.0 110.867 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 25.5 p -95.12 135.97 36.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 168.21 70.48 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.473 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -85.66 116.07 23.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.88 0.372 . . . . 0.0 110.939 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . 0.455 ' N ' HD21 ' A' ' 430' ' ' LEU . 3.8 mm? -80.71 155.82 73.19 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.583 0.706 . . . . 0.0 110.939 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 3.7 2.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.673 2.249 . . . . 0.0 112.319 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -86.0 -176.68 6.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.934 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -144.09 135.97 26.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.401 ' C ' ' CD ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -91.28 33.65 0.97 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -107.99 143.94 35.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 31.7 tp -66.98 120.66 14.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 33.3 t -59.12 134.02 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -79.37 12.08 2.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -117.71 -41.94 2.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.559 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 23.4 t80 -59.14 -33.41 70.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 70.6 mt -42.83 -33.0 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.4 p -101.48 -37.13 8.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.138 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.5 -8.42 17.58 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -100.13 80.97 2.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.897 0.38 . . . . 0.0 110.865 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 47.1 t -118.56 104.62 10.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.96 -64.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -78.21 105.56 9.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.852 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.42 -77.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.91 14.3 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.838 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -113.29 -17.25 12.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.856 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 8.0 t -65.95 111.21 5.9 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.552 0.692 . . . . 0.0 110.895 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 3.64 2.62 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.349 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -100.17 170.69 8.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 17.6 mmm -81.94 141.28 33.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -120.91 -77.61 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.8 -60.17 2.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.7 m-20 -34.45 -46.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.775 0.321 . . . . 0.0 110.832 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -46.65 126.21 8.09 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.664 0.745 . . . . 0.0 110.855 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 134.42 27.94 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.688 2.258 . . . . 0.0 112.331 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.4 t -53.16 145.19 14.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 21.0 tttm -80.12 -67.64 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.6 mt -44.76 -58.83 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.942 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.449 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 25.1 t80 -39.43 -25.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.96 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.515 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 30.4 m-70 -99.98 -54.15 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.453 ' C ' ' O ' ' A' ' 464' ' ' HIS . 33.8 p -33.79 -40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 80.6 p -126.92 -33.18 2.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.127 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.449 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 131.81 -40.24 1.66 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.505 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -109.8 149.92 29.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 0.0 110.899 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.62 143.8 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.8 tp -71.34 -39.09 71.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.096 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.74 -68.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 141.58 -154.81 24.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.498 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -74.38 -24.49 59.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -101.69 49.27 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -79.26 148.08 32.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.559 ' HE2' ' CE2' ' A' ' 440' ' ' TYR . 3.6 ppp? -80.57 17.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.522 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 12.4 m-85 -129.43 157.38 42.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.5 p -80.07 128.68 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.877 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -103.87 21.94 15.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.46 158.67 86.26 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.614 0.721 . . . . 0.0 110.845 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 119.28 6.26 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.665 2.243 . . . . 0.0 112.387 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.515 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 39.8 mt -42.5 150.2 0.15 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.947 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.0 p -128.79 154.9 45.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.145 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -39.92 -30.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -80.66 -75.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 489' ' ' LEU . 20.7 p -46.99 -46.84 21.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.146 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -43.58 1.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -58.29 -40.5 82.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.937 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' A' ' 486' ' ' THR . 48.6 mt -49.87 -64.29 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 85.2 mt -42.99 -54.0 4.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -41.38 -44.9 2.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -78.07 -59.18 2.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -44.19 -60.14 2.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.895 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 55.4 mt -41.39 -59.87 1.45 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -49.37 -52.32 29.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.109 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -42.43 -56.57 2.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.431 ' O ' ' C ' ' A' ' 498' ' ' ALA . 10.7 t0 -73.73 -63.69 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.86 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -33.59 -38.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -78.09 -61.21 2.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . 40.31 39.83 0.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.123 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -52.69 -43.85 59.97 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.46 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -121.57 85.22 2.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.776 0.322 . . . . 0.0 111.099 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -107.55 111.16 23.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.43 87.37 6.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.888 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -47.43 153.44 0.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.877 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -158.17 105.0 1.9 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -94.13 107.58 19.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.927 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -75.21 85.31 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.138 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -50.97 141.3 13.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -48.08 149.86 1.33 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.433 ' CD1' ' H ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -80.74 36.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? 46.69 40.84 9.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.92 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -40.1 150.04 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.86 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 33.1 p -144.94 176.87 9.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -175.98 104.73 0.19 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.473 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 -176.1 1.38 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.657 2.238 . . . . 0.0 112.361 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 53.8 p -156.34 177.37 11.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.842 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 79.7 p -157.61 173.08 17.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 CA-C-O 119.14 -0.811 . . . . 0.0 112.485 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 80.1 p -121.58 109.95 15.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.844 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 16.7 m -118.07 107.02 13.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.926 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -104.67 128.39 9.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 4.0 t -126.66 160.85 29.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.862 0.363 . . . . 0.0 110.893 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' SER . . . . . 0.412 ' HB2' ' NH2' ' A' ' 434' ' ' ARG . 52.8 p -103.3 83.21 2.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.854 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 65.49 115.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.497 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -79.34 44.91 0.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.869 0.366 . . . . 0.0 110.888 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -158.08 159.26 30.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.582 0.706 . . . . 0.0 110.927 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 97.48 0.64 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.663 2.242 . . . . 0.0 112.341 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -150.43 149.25 29.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -124.97 138.15 54.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.901 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.465 ' CG ' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -105.67 47.59 0.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.844 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -124.82 143.7 50.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.881 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.506 HD13 ' CD2' ' A' ' 458' ' ' PHE . 20.6 tp -73.59 102.65 3.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.89 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.8 t -40.02 124.1 1.76 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.883 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -68.05 -3.02 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -102.37 -51.52 3.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -47.78 -37.77 14.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.963 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.7 mt -41.17 -31.09 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.123 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 40.6 p -103.05 -33.93 9.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.94 -10.47 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.497 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -99.97 97.82 8.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 110.902 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.67 110.2 9.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.878 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.092 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 68.4 mtt180 -77.5 109.54 11.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.841 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.62 -77.16 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.125 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.74 5.8 17.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -103.29 -20.07 14.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.922 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 10.2 t -60.86 110.26 2.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.611 0.719 . . . . 0.0 110.872 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 4.27 2.29 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.8 178.33 4.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.918 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 22.7 mmm -91.62 140.42 29.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -120.59 -76.17 0.58 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.49 -64.95 1.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.495 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 28.0 t0 -32.6 -48.01 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.82 0.343 . . . . 0.0 110.871 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.506 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.9 t80 -40.55 125.92 1.84 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.759 . . . . 0.0 110.886 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 155.74 65.05 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.637 2.225 . . . . 0.0 112.36 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.514 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 14.0 t -73.5 146.03 45.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -79.54 -69.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.3 mt -44.14 -59.56 2.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.432 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 58.3 t80 -39.56 -25.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.552 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.7 m-70 -98.94 -50.83 4.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.823 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 464' ' ' HIS . 55.2 p -35.59 -43.24 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.427 ' N ' ' HG1' ' A' ' 465' ' ' THR . 32.5 p -125.96 -33.75 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.158 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.432 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 135.15 -38.12 1.84 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.514 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -108.56 166.24 10.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.2 t -126.25 131.77 51.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.4 tp -80.66 21.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -99.57 -46.89 5.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 114.81 174.31 18.24 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.503 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.5 -17.38 13.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -101.56 43.49 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.83 146.18 44.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.6 ppp? -71.59 -22.05 61.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.854 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 16.9 m-85 -100.55 159.19 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.6 m -79.94 135.9 36.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -101.02 24.46 9.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -62.51 153.44 77.16 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.582 0.705 . . . . 0.0 110.876 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 119.94 6.81 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.693 2.262 . . . . 0.0 112.355 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.552 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 80.0 mt -41.18 143.73 0.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 10.7 p -138.65 162.0 35.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.105 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -39.46 -35.63 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -80.22 -68.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.853 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 489' ' ' LEU . 5.7 p -52.89 -55.13 25.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.154 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.29 -49.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -52.24 -39.18 59.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.465 ' CD2' ' CG ' ' A' ' 434' ' ' ARG . 65.1 mt -49.6 -65.89 0.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.476 HD11 ' CD2' ' A' ' 464' ' ' HIS . 72.7 mt -39.81 -61.12 0.88 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.917 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.91 -39.56 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.842 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -79.47 -40.89 28.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -62.21 -59.76 4.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.872 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.88 -45.56 30.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.087 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -54.41 -40.62 68.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.833 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.69 -62.72 1.28 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.791 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -50.53 -61.17 2.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.081 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' A' ' 498' ' ' ALA . 15.8 tp10 -34.56 -51.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.5 96.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.136 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -173.35 -68.8 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -122.12 134.64 54.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 0.0 111.126 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -69.97 81.18 0.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -110.22 114.5 28.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -113.74 103.4 11.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 15.0 pttm -116.69 167.77 10.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.941 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -149.27 145.04 26.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.8 p -80.53 115.99 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.17 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -62.51 167.92 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.89 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 130.26 40.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.873 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 77.6 mt -115.95 -41.71 3.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -89.81 38.83 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -87.0 107.07 18.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.925 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 3.9 t -132.58 172.54 12.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.826 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -140.79 167.43 25.61 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 128.43 15.99 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.705 2.27 . . . . 0.0 112.337 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 71.3 m -82.75 159.1 22.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.849 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 15.2 m -110.5 149.12 30.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.513 -179.999 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 20.5 m -152.42 145.96 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 80.4 p -141.3 144.15 34.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 114.86 59.55 0.37 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 88.7 p -84.89 -47.18 10.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 9.1 t -112.67 131.82 55.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -139.31 50.37 0.79 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.511 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -125.55 90.32 3.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.918 0.39 . . . . 0.0 110.861 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.07 158.56 69.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.634 0.731 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.11 3.82 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.686 2.257 . . . . 0.0 112.347 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -144.61 178.85 7.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 452' ' ' PRO . 41.2 mttt -137.13 144.05 42.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.76 33.78 2.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.893 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -115.84 149.18 39.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.894 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 19.7 tp -79.39 105.45 10.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 439' ' ' PHE . 23.5 t -41.79 131.48 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -80.95 21.79 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.901 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . 0.4 ' H ' ' C ' ' A' ' 437' ' ' CYS . 24.8 m-85 -125.33 -42.2 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.905 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.566 ' CE2' ' HE3' ' A' ' 476' ' ' MET . 53.4 t80 -64.01 -27.7 69.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 96.5 mt -44.72 -37.19 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.3 -27.76 13.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.177 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.62 -10.17 16.45 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -100.73 105.76 17.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.891 0.377 . . . . 0.0 110.884 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 40.4 t -138.45 122.26 17.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.869 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -46.18 -67.45 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.155 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -86.12 114.47 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.64 -79.17 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.155 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -81.74 12.79 3.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -116.55 1.73 12.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.407 ' C ' ' H ' ' A' ' 453' ' ' TYR . 12.9 t -80.18 110.99 18.54 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.621 0.724 . . . . 0.0 110.866 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . 0.47 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.3 Cg_endo -69.77 7.08 1.08 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.407 ' H ' ' C ' ' A' ' 451' ' ' CYS . 59.3 m-85 -99.25 -177.15 3.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 44.3 mmm -97.84 126.25 43.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.873 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -109.95 -74.89 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.51 -60.28 2.37 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.458 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 51.6 m-20 -34.48 -45.46 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.858 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -47.03 128.77 9.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.654 0.74 . . . . 0.0 110.879 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 150.79 68.92 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.323 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.405 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.6 t -75.72 150.07 37.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 9.3 ttmt -80.01 -68.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.5 mt -45.5 -57.54 4.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 64.5 t80 -40.71 -24.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.567 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.9 m-70 -99.9 -53.39 3.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.45 ' HG1' ' N ' ' A' ' 466' ' ' THR . 43.6 p -34.7 -43.48 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.105 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.45 ' N ' ' HG1' ' A' ' 465' ' ' THR . 72.2 p -124.68 -35.23 2.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.13 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 136.46 -38.57 1.75 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.531 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -107.09 169.83 8.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 16.8 t -124.56 133.76 53.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.39 -38.84 82.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -50.28 -54.83 18.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 124.16 -159.35 18.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.449 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.77 -25.11 61.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.775 0.321 . . . . 0.0 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -99.95 47.21 0.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 33.9 t -78.1 149.41 33.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.6 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -80.66 18.54 0.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.6 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 20.2 m-85 -131.39 156.05 46.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.4 m -79.0 128.33 33.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.86 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -103.02 25.13 9.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.831 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.23 160.3 79.44 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.593 0.711 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 116.84 4.75 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.647 2.232 . . . . 0.0 112.359 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.567 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 37.8 mt -40.18 144.85 0.19 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 72.3 p -131.91 160.26 36.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -41.32 -32.67 0.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -78.27 -71.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.5 p -48.91 -51.15 31.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.126 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.47 -52.61 2.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.855 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -51.04 -49.7 60.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 94.2 mt -43.9 -65.18 0.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 35.9 mt -40.01 -57.32 1.66 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.7 -40.4 5.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.81 -52.43 9.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.3 tmm? -53.83 -64.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 18.3 mt -47.87 -56.39 7.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.933 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.17 -55.61 9.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.093 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.04 -48.57 75.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -38.76 -60.59 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.903 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -79.07 -56.26 4.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.059 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.434 ' C ' ' O ' ' A' ' 498' ' ' ALA . 12.5 tp10 -35.43 -45.6 0.34 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.88 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -34.51 98.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.077 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -125.28 -65.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.494 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -87.77 177.8 6.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.725 0.298 . . . . 0.0 111.112 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -147.86 160.23 43.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -166.32 119.5 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.52 169.44 14.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.864 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 17.7 mtmm -83.26 170.21 14.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -130.96 170.3 14.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.9 p -120.6 110.3 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.133 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -67.84 160.66 27.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.925 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.07 148.29 44.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -52.55 -173.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 513' ' ' LYS . 0.1 OUTLIER -74.65 50.76 0.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.915 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 512' ' ' LYS . 38.8 tttm -38.01 124.88 1.2 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.904 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 1.4 t -168.41 168.31 11.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.886 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -174.1 134.34 2.81 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.483 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -175.03 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.719 2.28 . . . . 0.0 112.355 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 67.6 m -153.8 140.48 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.865 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 14.9 m -117.77 171.4 8.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.861 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.489 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 17.3 t -111.22 139.67 46.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.854 0.359 . . . . 0.0 110.817 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 60.5 p -99.87 160.48 14.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.841 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -105.26 -101.2 2.69 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 3.8 m -114.44 138.69 50.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 20.6 t -89.78 -44.6 9.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 166.75 149.84 6.15 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.506 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -112.14 151.28 29.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.0 110.884 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.63 154.35 42.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.605 0.717 . . . . 0.0 110.9 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -0.29 6.69 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.694 2.263 . . . . 0.0 112.304 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -82.95 171.6 13.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.924 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -120.59 136.54 54.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.91 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.467 ' HB3' ' CD2' ' A' ' 489' ' ' LEU . 8.2 mpt_? -92.63 41.67 1.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -122.12 152.68 39.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 13.4 tp -78.93 115.75 18.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 27.0 t -45.68 131.11 9.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -75.24 0.55 16.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -108.17 -50.11 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.508 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 11.7 t80 -49.05 -30.05 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.8 mt -44.46 -33.75 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.086 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 60.2 p -103.91 -29.23 11.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.107 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.11 -10.11 22.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -98.6 99.38 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.86 104.81 5.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.44 -61.78 0.87 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.134 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -81.92 104.64 12.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.08 -74.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.087 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -81.42 2.7 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.899 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -104.51 -5.26 21.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.3 t -72.56 111.59 11.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.624 0.726 . . . . 0.0 110.864 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 2.02 3.88 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.688 2.259 . . . . 0.0 112.388 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -100.32 -174.64 2.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 29.1 mmm -98.19 142.34 29.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.877 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -121.23 -75.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.469 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.69 -66.28 1.65 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.43 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.469 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -33.0 -42.57 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.863 0.363 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.502 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.8 t80 -46.79 126.93 8.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.684 0.754 . . . . 0.0 110.861 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 144.94 55.45 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.255 . . . . 0.0 112.333 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 51.9 t -69.26 143.24 53.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . 0.411 ' CD ' ' HE2' ' A' ' 493' ' ' MET . 4.7 ttpm? -79.38 -65.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.89 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.5 mt -45.0 -57.84 3.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -40.51 -24.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.572 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 45.1 m-70 -100.66 -52.49 3.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.458 ' C ' ' O ' ' A' ' 464' ' ' HIS . 58.3 p -32.24 -42.28 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.158 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 62.8 p -127.84 -36.92 1.97 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.15 -33.18 2.56 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.475 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -116.81 143.73 45.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.839 0.352 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.4 t -101.92 107.33 18.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . 0.424 HG23 ' N ' ' A' ' 471' ' ' ASN . 5.6 tp -40.49 -36.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.185 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . 0.424 ' N ' HG23 ' A' ' 470' ' ' ILE . 58.1 m-20 -53.2 -61.87 2.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.881 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 107.45 -142.07 15.74 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.18 13.43 2.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.841 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -106.72 -25.22 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.895 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -43.14 125.87 3.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.605 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 0.8 OUTLIER -81.56 27.2 0.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.1 m-85 -125.29 158.1 34.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.6 m -80.12 137.68 36.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.831 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 38.0 m170 -108.59 17.98 21.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -60.31 153.43 58.78 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 117.13 4.9 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.709 2.273 . . . . 0.0 112.351 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.572 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 23.7 mt -39.65 151.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 40.5 p -139.18 165.58 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.113 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . 0.409 ' HG3' ' CD ' ' A' ' 485' ' ' GLU . 9.9 pt-20 -40.27 -38.5 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.409 ' CD ' ' HG3' ' A' ' 484' ' ' GLU . 48.0 mp0 -80.43 -76.3 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.915 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.446 ' O ' ' N ' ' A' ' 489' ' ' LEU . 17.4 p -41.49 -50.92 3.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.124 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 12.0 tpt180 -39.41 -44.36 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.15 -40.08 80.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.467 ' CD2' ' HB3' ' A' ' 434' ' ' ARG . 88.3 mt -46.68 -68.14 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.454 HD11 ' CD1' ' A' ' 482' ' ' LEU . 92.8 mt -40.43 -57.55 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -42.54 -36.11 1.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -80.17 -38.47 31.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' MET . . . . . 0.411 ' HE2' ' CD ' ' A' ' 461' ' ' LYS . 11.3 tmm? -68.88 -62.64 1.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.829 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -39.9 -49.18 2.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.896 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.79 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.093 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -47.81 -41.3 23.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.861 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -68.72 -66.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -48.78 -61.87 1.81 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.144 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' A' ' 500' ' ' ALA . 27.0 mt-10 -59.04 -50.19 75.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.402 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . 37.2 42.1 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.116 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 179.58 48.71 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.493 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -122.2 78.84 1.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -123.44 82.25 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.876 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -100.03 94.49 6.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.83 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -48.9 119.06 2.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.23 115.18 17.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.74 108.87 0.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.83 92.8 2.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.106 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 172.46 6.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -114.31 151.46 32.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.855 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.6 mp -53.95 -173.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.931 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -74.75 49.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.939 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -45.84 131.72 9.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.91 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 58.8 m -167.0 162.64 15.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.832 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -116.83 115.81 3.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.497 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.1 69.16 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.233 . . . . 0.0 112.359 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.4 t -122.67 158.95 28.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 23.5 m -111.45 173.27 6.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.856 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 CA-C-O 119.183 -0.787 . . . . 0.0 112.449 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 93.8 p -95.13 135.97 36.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.863 0.363 . . . . 0.0 110.894 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 3.3 t -86.21 137.93 32.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.867 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -101.56 86.02 0.58 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.439 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 95.3 p -82.49 43.22 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.847 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 57.7 m -107.06 149.15 27.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 158.89 57.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.514 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -84.56 101.02 11.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.828 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . 0.424 ' N ' HD21 ' A' ' 430' ' ' LEU . 4.0 mm? -101.15 150.75 37.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 0.0 110.9 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -91.55 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.664 2.243 . . . . 0.0 112.386 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -80.28 175.92 10.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.896 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -94.9 -23.0 17.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 57.48 42.08 25.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -138.32 154.29 48.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.429 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 32.8 tp -79.54 105.09 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.7 t -40.52 123.78 1.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -69.41 -3.16 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -105.28 -51.43 3.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.423 ' HB2' ' NE2' ' A' ' 455' ' ' HIS . 31.6 t80 -44.58 -37.64 3.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -41.03 -36.24 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.147 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 11.1 p -101.21 -35.23 9.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.99 -9.81 11.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.489 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . 0.462 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 5.5 t80 -95.31 83.25 3.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.904 0.383 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 22.1 t -118.42 113.93 22.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -43.95 -72.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.114 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 84.2 mtt85 -80.17 109.41 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.65 -73.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -76.06 -5.66 47.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -110.47 20.34 17.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 37.6 t -80.53 111.81 25.99 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.629 0.728 . . . . 0.0 110.909 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 1.43 4.46 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.691 2.261 . . . . 0.0 112.359 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -105.67 -176.08 2.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' MET . . . . . 0.464 ' CE ' ' HB2' ' A' ' 457' ' ' ASP . 29.1 mmm -100.78 140.58 34.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.924 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.423 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.4 m170 -119.9 -75.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -78.13 -67.3 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.5 m-20 -32.99 -44.72 0.12 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.856 0.36 . . . . 0.0 110.884 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.429 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 15.2 t80 -45.28 126.24 5.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.633 0.73 . . . . 0.0 110.897 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 143.58 51.48 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.699 2.266 . . . . 0.0 112.341 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.432 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.1 t -70.69 145.03 50.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -77.25 -64.99 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.8 mt -44.73 -59.44 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.446 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 87.5 t80 -39.62 -25.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 462' ' ' LEU . 42.9 m-70 -98.87 -53.61 3.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.885 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 464' ' ' HIS . 51.2 p -34.48 -34.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.126 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.0 p -133.59 -40.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.124 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.446 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 141.22 -38.57 1.52 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.46 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.43 152.1 30.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.1 t -102.26 141.73 34.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.3 tp -80.23 -26.08 11.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -50.92 -49.61 59.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 129.64 -167.17 21.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.478 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.49 -35.79 79.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.831 0.348 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -100.57 58.8 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.66 149.08 40.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.934 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -76.51 6.57 5.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 15.7 m-85 -125.78 154.74 42.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.844 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 23.3 m -80.37 141.44 35.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.25 26.98 10.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -64.97 153.76 88.02 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.624 0.726 . . . . 0.0 110.869 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 109.66 2.35 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.698 2.266 . . . . 0.0 112.39 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.443 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 47.4 mt -39.73 152.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' N ' ' A' ' 485' ' ' GLU . 72.5 p -137.46 158.51 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -38.95 -30.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.858 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.2 mm-40 -81.4 -74.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.42 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.1 p -46.24 -47.61 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.14 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.11 -47.04 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.86 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -56.99 -41.38 78.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 486' ' ' THR . 74.1 mt -47.66 -63.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 72.1 mt -39.87 -60.03 1.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.929 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -40.26 -45.94 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.883 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 44.3 tttp -72.42 -49.11 35.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -48.23 -59.22 3.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.428 HD22 ' N ' ' A' ' 494' ' ' LEU . 4.0 mm? -45.79 -47.07 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.44 ' O ' ' C ' ' A' ' 496' ' ' ASP . . . -66.91 -65.62 0.66 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.095 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . 0.44 ' C ' ' O ' ' A' ' 495' ' ' ALA . 1.9 m-20 -34.47 -48.59 0.36 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -40.28 -62.15 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -74.3 -55.51 5.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.099 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 498' ' ' ALA . 1.7 tm-20 -36.79 -42.41 0.38 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -42.25 98.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -110.61 -47.18 0.8 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.471 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.63 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.762 0.315 . . . . 0.0 111.09 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -134.63 -34.06 0.94 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.916 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -78.02 110.53 13.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.84 138.33 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -134.92 107.15 7.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -164.48 133.71 3.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 4.1 p -112.64 120.35 62.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.115 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -100.71 134.86 43.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -99.72 152.03 20.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.426 ' CD1' ' O ' ' A' ' 511' ' ' LEU . 3.9 pp -110.53 41.96 1.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 65.82 41.59 3.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -54.05 164.57 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.953 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 18.5 m 66.32 45.09 2.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.831 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -60.15 156.92 28.61 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.473 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 136.24 32.37 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.252 . . . . 0.0 112.352 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 57.8 m -114.72 109.87 18.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 15.8 t -74.02 -59.57 2.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.834 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 CA-C-O 119.176 -0.791 . . . . 0.0 112.471 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.458 -0.257 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 4.1 t -146.51 133.52 20.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.844 0.354 . . . . 0.0 110.898 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 48.7 m -134.08 115.31 14.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.872 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -162.39 137.34 4.79 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.546 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 40.5 p -161.9 167.52 24.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 110.859 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 13.3 t -164.58 154.14 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.829 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 178.95 75.42 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.47 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.57 162.68 26.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.902 0.382 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 18.9 mt -149.09 140.52 14.33 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.569 0.7 . . . . 0.0 110.908 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . 0.403 ' C ' ' HG2' ' A' ' 432' ' ' LYS . 53.8 Cg_endo -69.75 81.7 0.8 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 0.0 112.344 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . 0.403 ' HG2' ' C ' ' A' ' 431' ' ' PRO . 54.1 mmtt -152.3 176.63 11.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.859 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.455 ' HD3' ' CE2' ' A' ' 453' ' ' TYR . 6.9 mtpt -113.44 -18.75 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.464 ' HB3' ' CD2' ' A' ' 489' ' ' LEU . 0.1 OUTLIER 58.83 38.35 24.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.85 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.04 135.14 32.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 53.9 tp -60.61 117.42 5.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 439' ' ' PHE . 28.3 t -58.86 126.4 27.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.841 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.32 29.03 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . 0.4 ' H ' ' C ' ' A' ' 437' ' ' CYS . 36.1 m-85 -134.61 -42.09 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.605 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 47.1 t80 -66.91 -21.86 65.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.905 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 61.7 mt -52.84 -32.8 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.143 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 61.1 p -108.26 11.29 27.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.57 -8.73 25.67 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -99.67 99.62 10.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.3 t -136.26 117.25 14.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.09 -67.59 0.27 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.081 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -85.72 114.41 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.21 -76.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.128 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -81.41 -2.57 49.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -105.59 11.99 31.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 20.1 t -80.81 111.32 22.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.631 0.729 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 0.77 5.2 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.675 2.25 . . . . 0.0 112.331 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.455 ' CE2' ' HD3' ' A' ' 433' ' ' LYS . 57.6 m-85 -100.3 -174.97 2.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.4 mmm -100.54 143.03 31.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.922 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.476 ' CE1' ' HB2' ' A' ' 440' ' ' TYR . 13.6 m170 -122.04 -75.28 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.64 -69.44 1.4 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.466 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.491 ' C ' ' O ' ' A' ' 456' ' ' GLY . 20.3 t0 -31.05 -41.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.504 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 14.7 t80 -49.31 117.78 7.16 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.864 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 129.45 17.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.721 2.281 . . . . 0.0 112.311 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 138.17 13.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -73.99 -66.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 49.0 mt -45.02 -58.7 3.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' A' ' 467' ' ' GLY . 69.4 t80 -39.74 -24.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.578 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 44.4 m-70 -100.75 -53.19 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.826 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.4 p -29.64 -42.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.193 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 464' ' ' HIS . 65.9 p -126.66 -39.53 1.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 463' ' ' TYR . . . 146.72 -38.06 1.16 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.51 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . 0.401 ' C ' ' HA ' ' A' ' 463' ' ' TYR . 45.1 p-10 -113.83 168.93 9.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.855 0.359 . . . . 0.0 110.918 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.33 140.38 48.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -76.98 -33.28 20.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.102 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -50.42 -65.46 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 145.87 -164.35 28.2 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.502 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.15 -22.63 59.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.822 0.344 . . . . 0.0 110.888 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -99.76 48.89 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.409 ' C ' ' H ' ' A' ' 477' ' ' PHE . 54.1 t -79.46 141.32 36.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.605 ' CE ' ' CE2' ' A' ' 440' ' ' TYR . 4.7 ppp? -81.11 25.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 24.1 m-85 -134.59 157.23 47.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.86 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.5 p -80.1 135.47 36.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -111.49 28.15 9.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.881 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.47 163.32 69.1 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.608 0.718 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 120.08 6.92 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.701 2.268 . . . . 0.0 112.318 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.578 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.3 mt -40.91 143.79 0.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 39.4 p -126.54 156.09 41.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -39.87 -34.1 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -76.74 -74.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.879 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 489' ' ' LEU . 20.4 p -45.16 -50.44 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.146 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . 0.466 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.03 -49.59 1.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -50.83 -45.31 59.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.464 ' CD2' ' HB3' ' A' ' 434' ' ' ARG . 93.8 mt -48.2 -64.1 0.89 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 97.1 mt -39.82 -53.75 2.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -46.13 -47.33 17.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.843 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -73.66 -57.74 3.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.86 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -46.4 -64.23 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.869 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.44 HD11 ' N ' ' A' ' 494' ' ' LEU . 10.5 mp -50.26 -53.94 24.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.953 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -49.44 -47.04 48.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.157 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -49.22 -50.12 39.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.835 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.88 -57.05 14.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.877 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -58.77 -66.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.113 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 498' ' ' ALA . 36.8 tt0 -31.36 -58.55 0.25 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.882 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -32.3 101.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.136 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 71.84 55.02 7.63 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.45 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -162.16 154.31 19.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 0.0 111.085 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -89.08 141.23 28.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.952 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -140.11 156.86 46.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.881 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -147.36 133.85 19.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -156.65 131.81 9.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.78 164.69 28.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 86.7 t -109.08 117.72 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.084 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.93 156.68 36.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -120.61 176.37 5.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' A' ' 512' ' ' LYS . 1.7 pt? -124.69 43.64 2.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.452 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER 34.38 53.18 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -45.18 104.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 3.8 t -106.84 -47.67 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.838 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 89.65 162.77 38.7 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 158.17 57.82 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.688 2.259 . . . . 0.0 112.35 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 24.3 p -109.25 141.64 41.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.884 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 78.4 p -111.78 168.51 9.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 119.161 -0.799 . . . . 0.0 112.477 -179.979 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 44.1 t -90.24 130.61 36.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.854 0.359 . . . . 0.0 110.85 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 41.9 t -128.33 148.66 50.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -144.32 153.74 25.28 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.484 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 45.5 t -150.19 163.9 37.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.844 0.354 . . . . 0.0 110.899 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 2.8 m -147.84 161.46 41.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.88 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 132.31 163.0 10.54 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.506 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -70.95 102.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.874 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . 0.504 ' CD2' ' C ' ' A' ' 430' ' ' LEU . 0.0 OUTLIER -67.35 143.66 97.49 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.65 0.738 . . . . 0.0 110.914 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 -92.15 0.01 OUTLIER 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.685 2.257 . . . . 0.0 112.323 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.1 mmtt -63.33 130.23 43.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.537 ' HE3' ' CE1' ' A' ' 453' ' ' TYR . 22.6 mtmt -92.21 14.43 16.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.907 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 38.14 50.33 1.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . 0.471 ' HB3' ' CD2' ' A' ' 453' ' ' TYR . 14.2 tt0 -138.07 145.05 41.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.918 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.426 HD12 ' CD2' ' A' ' 458' ' ' PHE . 19.6 tp -72.99 112.26 8.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.938 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 18.5 t -43.28 141.75 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.461 ' HG2' ' CD1' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -79.89 -5.64 55.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.91 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . 0.461 ' CD1' ' HG2' ' A' ' 438' ' ' LYS . 46.3 m-85 -110.17 -54.03 2.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -42.2 -23.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.9 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 439' ' ' PHE . 61.8 mt -50.53 -40.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.107 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 41.3 p -99.71 6.24 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.158 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 79.87 -9.61 44.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.464 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -99.85 100.88 11.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.369 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.3 t -131.41 122.96 27.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.5 -59.08 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.118 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -88.65 107.96 19.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.81 -77.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -82.59 25.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -132.87 0.85 3.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.928 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.9 t -78.89 111.73 21.96 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.66 0.743 . . . . 0.0 110.869 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 5.17 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.716 2.277 . . . . 0.0 112.291 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.537 ' CE1' ' HE3' ' A' ' 433' ' ' LYS . 20.7 m-85 -99.93 -176.27 3.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.967 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.2 mmm -95.43 134.61 38.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -117.19 -75.51 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.29 -62.15 2.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.477 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 10.0 m-20 -34.74 -50.69 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 0.0 110.823 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.426 ' CD2' HD12 ' A' ' 436' ' ' LEU . 21.3 t80 -40.14 123.97 1.67 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 0.0 110.865 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 151.5 69.19 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.638 2.225 . . . . 0.0 112.322 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.543 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.8 t -73.95 145.96 44.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 29.6 tttt -78.76 -68.06 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.3 mt -44.25 -59.73 2.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.472 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 70.7 t80 -39.5 -25.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.924 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 30.2 m-70 -99.08 -52.93 3.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.429 ' C ' ' O ' ' A' ' 464' ' ' HIS . 53.1 p -34.75 -35.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.3 p -132.96 -37.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.472 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.34 -41.22 1.35 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.513 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.96 165.71 11.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.896 0.379 . . . . 0.0 110.87 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 47.5 t -117.9 150.16 39.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.9 tp -79.83 -34.85 15.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.154 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -53.54 -66.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 135.85 -171.08 22.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.445 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -35.02 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.818 0.342 . . . . 0.0 110.854 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -100.22 59.85 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 24.7 t -79.47 152.51 30.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.586 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 3.6 ppp? -68.73 -21.79 64.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.912 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.586 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.6 m-85 -105.51 159.41 15.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 27.3 m -79.12 140.38 37.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -104.24 24.34 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.16 154.6 60.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.6 0.714 . . . . 0.0 110.856 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 120.08 6.93 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.731 2.288 . . . . 0.0 112.347 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.514 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 41.1 mt -40.14 143.34 0.29 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 46.8 p -126.71 153.35 45.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.104 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 485' ' ' GLU . 4.3 pt-20 -40.26 -30.78 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.438 ' N ' ' HG3' ' A' ' 484' ' ' GLU . 11.5 tp10 -80.31 -73.64 0.35 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 60.2 p -45.0 -48.03 11.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.13 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.67 -42.27 1.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.832 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -61.31 -43.78 98.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.874 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 23.4 mt -45.03 -64.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 75.1 mt -39.87 -57.27 1.62 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.951 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.38 -43.58 1.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -79.0 -51.92 8.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.9 tmm? -53.69 -63.31 1.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 21.4 mt -44.3 -46.34 9.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -66.06 -41.22 91.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.069 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.2 -44.95 72.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -69.92 -63.59 1.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.846 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -44.01 -55.74 4.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.085 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.48 -44.79 69.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -79.84 46.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.118 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 93.52 151.83 28.52 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -164.12 109.68 1.03 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 111.086 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -144.45 155.94 43.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -157.9 163.18 38.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . 0.404 ' C ' ' HG3' ' A' ' 506' ' ' LYS . 0.6 OUTLIER -173.42 158.75 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . 0.404 ' HG3' ' C ' ' A' ' 505' ' ' GLU . 42.1 mtpt -150.63 176.13 11.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.9 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -163.48 144.37 9.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 91.4 t -125.53 103.47 11.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.9 mp0 -52.36 175.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -66.06 166.17 12.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 1.8 pp -146.47 129.43 16.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 51.32 36.55 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.94 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . 0.458 ' HG2' ' N ' ' A' ' 514' ' ' SER . 48.0 tttm -38.14 154.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.879 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.458 ' N ' ' HG2' ' A' ' 513' ' ' LYS . 3.9 t -46.45 166.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.864 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 171.98 74.21 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.522 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 -174.95 0.99 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.681 2.254 . . . . 0.0 112.391 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 94.8 p -163.68 169.26 18.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 56.1 m -144.45 178.04 8.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.881 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 CA-C-O 119.107 -0.829 . . . . 0.0 112.529 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.496 -0.241 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 43.1 t -139.42 109.45 6.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.907 0.384 . . . . 0.0 110.876 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 36.8 p -38.25 113.2 0.27 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 426' ' ' SER . . . 158.32 66.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.4 ' C ' ' O ' ' A' ' 425' ' ' GLY . 41.8 m -37.67 133.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.932 0.396 . . . . 0.0 110.848 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 38.7 m -102.33 115.08 29.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.854 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 142.79 51.25 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -120.51 124.48 45.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.857 0.36 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 22.0 mt -135.05 155.0 79.43 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.592 0.71 . . . . 0.0 110.894 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.83 89.98 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 0.0 112.359 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -139.65 179.82 6.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -131.08 96.53 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.02 54.19 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . 0.423 ' OE2' ' N ' ' A' ' 436' ' ' LEU . 0.8 OUTLIER -131.08 138.68 49.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 40.2 tp -57.91 114.42 2.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.8 t -47.72 138.42 8.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.92 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -77.02 -3.38 38.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -110.18 -51.06 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.56 ' CE2' ' HE1' ' A' ' 476' ' ' MET . 21.9 t80 -43.15 -35.75 1.47 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.8 mt -39.89 -37.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 16.5 p -99.35 -36.01 9.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.162 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.08 11.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -97.19 88.88 4.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.875 0.369 . . . . 0.0 110.888 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 51.2 t -128.28 99.38 5.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.854 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -38.63 -61.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.108 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 61.9 mtt180 -77.31 105.18 8.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.58 -76.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 449' ' ' GLU . 32.2 tt0 -82.92 7.02 16.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -107.56 -12.03 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 18.4 t -68.63 111.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.587 0.708 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 4.47 2.19 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.672 2.248 . . . . 0.0 112.326 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -99.6 176.46 5.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.927 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 15.1 mmm -88.65 140.95 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.891 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -122.14 -74.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.505 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.39 -67.97 1.51 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.455 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.505 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.4 m-20 -29.94 -49.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.884 0.373 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.4 t80 -41.57 128.2 2.36 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.645 0.736 . . . . 0.0 110.884 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 150.01 67.59 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.67 2.247 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 52.8 t -72.23 142.29 48.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -76.83 -66.47 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 464' ' ' HIS . 33.0 mt -45.81 -57.76 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -42.48 -23.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.933 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.569 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 29.1 m-70 -99.02 -50.17 4.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.491 ' C ' ' O ' ' A' ' 464' ' ' HIS . 72.0 p -30.51 -47.84 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.118 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.9 p -127.23 -31.91 2.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.163 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.68 -34.05 2.46 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -110.46 145.33 37.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 0.0 110.902 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.0 t -106.36 118.64 37.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -50.26 -37.84 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -49.92 -50.45 46.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 106.4 -152.86 17.03 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.496 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -80.07 12.91 2.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 0.0 110.845 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -123.95 34.35 5.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 45.6 t -79.56 139.58 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.56 ' HE1' ' CE2' ' A' ' 440' ' ' TYR . 4.4 ppp? -81.1 22.46 0.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.401 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 16.0 m-85 -130.9 161.49 31.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.863 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.9 m -80.1 127.11 31.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.852 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -99.68 26.65 6.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.832 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . 0.405 ' HB2' ' HD2' ' A' ' 481' ' ' PRO . 3.1 p30 -69.68 154.86 94.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . 0.405 ' HD2' ' HB2' ' A' ' 480' ' ' ASP . 53.5 Cg_endo -69.76 120.55 7.32 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.714 2.276 . . . . 0.0 112.372 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.569 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 54.4 mt -39.79 132.06 1.76 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 69.4 p -109.45 172.24 6.97 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -49.7 -35.68 22.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' A' ' 486' ' ' THR . 9.4 tp10 -78.54 -75.33 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 485' ' ' GLU . 49.6 p -36.37 -52.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.134 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . 0.403 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.6 OUTLIER -39.99 -47.12 2.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.09 -44.35 95.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 486' ' ' THR . 78.1 mt -48.85 -65.68 0.53 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.455 ' CD1' HD23 ' A' ' 482' ' ' LEU . 45.2 mt -40.08 -55.27 2.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -42.81 -41.67 3.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . 0.45 ' HD3' ' C ' ' A' ' 492' ' ' LYS . 7.2 tmtm? -76.9 -53.26 8.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -50.87 -58.96 4.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.847 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 64.5 mt -56.65 -55.5 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.87 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.51 -60.18 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.07 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -41.4 -42.52 2.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.873 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -74.56 -67.39 0.63 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -38.22 -44.05 0.83 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 500' ' ' ALA . 20.4 tt0 -68.2 -55.33 12.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.894 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -37.92 -59.1 0.87 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.056 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -164.86 130.58 2.2 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.468 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -91.04 154.74 19.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.762 0.315 . . . . 0.0 111.066 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . 0.463 ' HG2' ' N ' ' A' ' 504' ' ' ASP . 17.2 tt0 -164.5 151.47 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . 0.463 ' N ' ' HG2' ' A' ' 503' ' ' GLU . 6.6 m-20 61.47 45.23 8.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -103.39 40.33 1.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -157.18 141.03 16.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.857 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -85.05 125.11 32.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 87.5 t -74.24 81.66 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -96.23 95.19 7.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.26 150.22 14.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 24.1 mt -52.95 -173.18 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 49.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.5 125.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.905 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 4.2 m -162.12 163.77 28.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -160.61 136.9 4.71 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.495 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 -174.86 1.0 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.649 2.233 . . . . 0.0 112.35 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.3 t -124.66 146.66 48.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.817 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 3.6 t -114.79 163.97 14.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.905 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 119.151 -0.805 . . . . 0.0 112.434 -179.996 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 11.6 t -161.51 130.82 4.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 0.0 110.836 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 90.4 p -153.15 137.34 16.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.892 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 133.96 77.22 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 14.5 t -145.36 108.34 4.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.852 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 58.6 p -80.5 75.16 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.793 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -91.67 36.56 3.61 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.526 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -161.05 146.17 14.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 40.7 mt -119.76 157.43 52.32 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 0.0 110.901 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 2.41 3.58 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.656 2.237 . . . . 0.0 112.354 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp -106.48 114.0 27.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.849 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.478 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 63.1 mttt -86.52 111.89 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -79.05 48.31 0.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.862 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -121.64 152.39 39.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.554 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 40.5 tp -67.52 124.0 22.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.935 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 17.1 t -57.26 127.6 32.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.04 -3.38 16.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -107.62 -44.06 4.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.45 ' CD2' ' CG ' ' A' ' 455' ' ' HIS . 30.4 t80 -51.65 -38.57 55.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.902 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.7 mt -39.58 -35.38 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.119 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.97 -31.27 11.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.133 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 112.89 -4.22 25.79 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.479 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . 0.451 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -100.33 85.91 3.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.875 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 48.6 t -121.27 102.54 8.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.867 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.14 -69.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.8 mtt85 -76.9 104.65 7.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.909 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.94 -74.55 0.32 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -81.93 21.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.944 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -128.82 -4.28 5.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 32.8 t -70.66 111.74 10.68 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.632 0.729 . . . . 0.0 110.906 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 2.39 3.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.478 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 44.4 m-85 -100.99 177.14 5.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' MET . . . . . 0.406 ' HE3' ' CB ' ' A' ' 457' ' ' ASP . 37.8 mmm -90.97 142.54 27.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.45 ' CG ' ' CD2' ' A' ' 440' ' ' TYR . 18.5 m170 -120.36 -75.77 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.46 -64.84 1.79 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.457 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -32.29 -47.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.554 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 21.6 t80 -46.16 122.59 6.43 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.727 . . . . 0.0 110.864 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 143.86 51.8 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.325 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.6 t -65.7 135.56 55.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . 0.472 ' HD3' ' CE ' ' A' ' 493' ' ' MET . 6.5 ttpt -73.44 -64.96 0.88 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 464' ' ' HIS . 44.3 mt -44.44 -58.31 3.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.401 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 28.0 t80 -39.11 -25.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' A' ' 462' ' ' LEU . 64.3 m-70 -100.67 -55.33 2.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.822 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.466 ' C ' ' O ' ' A' ' 464' ' ' HIS . 30.2 p -32.98 -39.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.2 p -128.58 -38.29 1.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.401 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 138.27 -38.26 1.71 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.523 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -111.01 155.42 22.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.856 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 23.9 t -106.52 136.09 46.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.1 tp -76.07 -25.97 17.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -56.33 -39.38 72.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 109.75 -161.11 13.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.516 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.8 -13.75 59.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.832 0.349 . . . . 0.0 110.935 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -99.98 29.62 4.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -71.96 131.37 42.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.566 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.25 34.04 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.566 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 10.7 m-85 -132.92 155.12 49.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.922 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.7 m -80.18 127.91 32.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -99.76 15.67 26.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.31 156.23 61.92 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.597 0.713 . . . . 0.0 110.864 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 119.71 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.615 2.21 . . . . 0.0 112.35 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.463 HD11 ' CD1' ' A' ' 490' ' ' LEU . 29.0 mt -39.87 147.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 82.1 p -126.27 157.86 37.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.095 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -41.91 -33.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -80.96 -76.4 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 489' ' ' LEU . 59.6 p -44.92 -48.99 11.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.165 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -38.86 -45.16 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -56.22 -41.31 75.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 486' ' ' THR . 51.9 mt -45.88 -62.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.463 ' CD1' HD11 ' A' ' 482' ' ' LEU . 81.8 mt -41.74 -56.55 2.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.958 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -42.72 -41.99 3.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -80.2 -60.01 2.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' MET . . . . . 0.472 ' CE ' ' HD3' ' A' ' 461' ' ' LYS . 13.4 tmm? -41.6 -57.4 2.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.895 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.486 ' N ' HD12 ' A' ' 494' ' ' LEU . 10.4 mp -56.14 -49.27 74.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.933 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -43.41 -53.24 5.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.083 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -55.61 -40.77 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 500' ' ' ALA . 22.6 t0 -67.72 -59.29 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.853 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -53.51 -45.97 69.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.103 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -83.99 19.12 1.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 497' ' ' ASP . . . -68.34 91.77 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.081 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . -71.28 70.41 0.83 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.483 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . 0.45 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . 33.67 42.34 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.759 0.314 . . . . 0.0 111.04 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 -45.83 152.34 0.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.891 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -98.69 121.9 41.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -142.44 129.97 21.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.92 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 16.5 mtmm -163.11 154.26 17.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -120.77 179.55 4.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.1 p -105.39 129.43 58.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -90.46 171.42 9.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -110.35 134.79 51.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.877 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.93 44.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.911 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 513' ' ' LYS . 17.5 tttm 40.23 40.58 0.83 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.914 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 512' ' ' LYS . 9.4 tmtt? -36.97 122.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 75.8 m -136.68 155.07 50.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.866 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -152.09 90.96 0.13 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.522 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 179.31 3.79 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 0.0 112.325 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 15.4 m -145.94 155.91 43.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 38.5 m -145.21 167.3 23.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.135 -0.814 . . . . 0.0 112.495 -179.976 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 70.9 m 63.5 42.15 6.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 92.0 p -79.92 148.92 31.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -98.57 -151.51 27.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.506 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 99.7 p -159.9 172.1 18.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 0.0 110.885 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 55.3 p -101.34 153.16 19.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.836 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -115.29 44.9 1.39 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.462 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.07 130.52 47.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.909 0.385 . . . . 0.0 110.832 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 7.2 mp -97.56 157.85 34.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.62 0.724 . . . . 0.0 110.907 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 3.06 3.02 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.657 2.238 . . . . 0.0 112.287 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -87.26 139.36 30.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.509 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 18.5 mttp -113.93 149.88 34.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.907 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -118.88 44.77 2.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -120.16 154.48 34.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.897 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 35.6 tp -70.86 129.02 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.4 t -66.0 131.63 46.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.919 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.42 2.53 9.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.933 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -114.95 -47.46 2.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.511 ' CE2' ' HE2' ' A' ' 476' ' ' MET . 31.6 t80 -48.17 -35.2 11.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.9 mt -41.12 -33.85 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.168 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 66.6 p -99.74 -33.33 10.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.09 -9.08 13.95 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.15 98.57 9.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.378 . . . . 0.0 110.834 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.6 t -134.5 111.56 10.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.04 -62.08 0.78 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 45.6 mtt180 -85.28 111.07 19.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.93 -79.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.086 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.06 0.99 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -102.17 -5.07 24.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 9.7 t -70.38 111.92 11.07 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.59 0.71 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.659 2.239 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.509 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -100.29 -176.17 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.93 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 21.2 mmm -97.36 138.75 34.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.5 m170 -119.82 -75.39 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.43 -62.26 2.09 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.455 ' C ' ' O ' ' A' ' 456' ' ' GLY . 68.9 m-20 -34.18 -50.92 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 110.875 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -40.84 127.96 1.94 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.679 0.752 . . . . 0.0 110.886 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 140.42 42.69 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.681 2.254 . . . . 0.0 112.354 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 13.7 t -59.13 144.28 46.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.902 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 56.1 tttp -77.97 -68.84 0.59 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.86 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.483 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.8 mt -45.15 -58.09 3.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.448 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 54.9 t80 -40.25 -24.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.897 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.552 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.5 m-70 -100.17 -52.42 3.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.433 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.6 p -33.44 -41.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.149 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 38.1 p -128.37 -29.22 2.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.448 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 128.75 -38.74 1.99 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.439 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -109.83 149.08 30.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.851 0.358 . . . . 0.0 110.885 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.1 t -102.22 131.43 48.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.898 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.5 tp -77.73 -21.94 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.143 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -50.63 -48.25 58.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 132.14 -168.97 22.33 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.508 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.94 -33.81 72.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.842 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.02 64.06 0.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.0 t -73.58 153.35 40.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.895 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.535 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.9 ppp? -75.61 -20.03 58.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.535 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 18.0 m-85 -104.26 161.17 14.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.867 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 68.5 m -79.97 151.27 30.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 48.6 m170 -115.04 30.2 7.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.91 157.86 85.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.586 0.708 . . . . 0.0 110.906 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 131.27 20.8 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.713 2.275 . . . . 0.0 112.306 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.552 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 38.6 mt -56.15 149.38 16.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 485' ' ' GLU . 66.4 p -136.35 154.97 50.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.132 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.79 -29.7 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.4 mt-10 -78.94 -74.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.913 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.3 p -48.6 -50.64 31.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.108 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -48.53 2.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.852 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -52.52 -40.77 62.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 77.2 mt -53.26 -61.25 2.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.872 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.429 ' CD1' HD22 ' A' ' 482' ' ' LEU . 94.9 mt -41.87 -56.65 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -41.95 -40.61 2.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.871 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.09 -57.18 3.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.894 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.7 tmm? -48.96 -60.56 2.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 96.6 mt -40.97 -44.95 2.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.19 96.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.099 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -50.96 -41.68 59.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.849 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -85.99 -55.45 3.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -43.01 -55.91 3.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.087 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -48.57 -52.07 24.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -58.06 -60.5 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.08 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . 117.79 76.79 0.57 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . -35.36 102.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.748 0.309 . . . . 0.0 111.11 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -69.87 99.42 1.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -87.75 97.41 10.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -109.29 161.36 15.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -140.54 125.01 17.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.872 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -82.25 149.47 27.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p -112.86 124.15 69.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -112.29 143.35 43.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -51.87 159.36 0.85 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.427 ' HG ' ' N ' ' A' ' 512' ' ' LYS . 2.0 pt? -134.77 -35.8 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.427 ' N ' ' HG ' ' A' ' 511' ' ' LEU . 7.8 ttpt -101.19 41.22 1.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -81.1 95.43 6.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 5.3 t -127.91 165.38 20.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.84 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.19 14.67 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.482 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -175.58 1.2 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.682 2.255 . . . . 0.0 112.317 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 46.1 m -145.69 154.04 41.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.841 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 19.6 m -158.24 153.77 26.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 CA-C-O 119.102 -0.832 . . . . 0.0 112.516 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 64.4 m -109.08 110.6 21.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 88.7 p -110.01 165.52 11.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.843 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 124.77 107.1 1.68 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.464 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 2.3 m -136.13 110.92 8.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.895 0.379 . . . . 0.0 110.838 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 90.4 p -99.53 109.54 22.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.856 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -148.25 96.36 0.17 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.43 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -79.38 166.3 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.92 0.39 . . . . 0.0 110.873 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.9 mp -128.42 159.51 67.2 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.601 0.715 . . . . 0.0 110.926 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 3.24 2.9 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.693 2.262 . . . . 0.0 112.339 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp -93.46 144.34 25.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.479 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 11.3 mttp -105.24 148.75 26.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -121.59 42.98 2.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.867 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -116.58 151.4 36.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.44 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 37.3 tp -58.73 125.99 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.874 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 14.7 t -65.06 146.25 55.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -79.91 -10.64 59.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.88 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -104.1 -46.14 4.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.409 ' CZ ' ' HB3' ' A' ' 455' ' ' HIS . 21.9 t80 -47.43 -36.33 9.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.889 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.1 mt -42.95 -37.68 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.114 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 70.8 p -101.6 -36.69 8.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.138 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.46 -4.76 17.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 10.6 t80 -99.63 71.33 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 110.853 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.77 105.31 15.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -61.27 0.88 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.104 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -83.44 109.48 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.871 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.74 -78.58 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.125 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -81.34 -1.21 44.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -99.4 0.07 41.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 10.3 t -80.08 111.11 19.31 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.627 0.727 . . . . 0.0 110.885 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 3.83 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.7 2.267 . . . . 0.0 112.336 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.479 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -99.87 179.99 4.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.0 mmm -95.16 140.54 29.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.823 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.409 ' HB3' ' CZ ' ' A' ' 440' ' ' TYR . 18.8 m170 -119.19 -76.11 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.37 -65.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.464 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.451 ' C ' ' O ' ' A' ' 456' ' ' GLY . 29.0 m-20 -33.93 -43.69 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.862 0.363 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.44 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.6 t80 -43.19 128.48 3.46 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.598 0.713 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 149.25 66.7 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.645 2.23 . . . . 0.0 112.399 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.467 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 9.2 t -74.28 150.3 40.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.89 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 16.3 ttmt -80.75 -69.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.1 mt -43.77 -60.3 1.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . 0.412 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 86.3 t80 -39.29 -25.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 13.6 m-70 -99.48 -51.67 3.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 464' ' ' HIS . 54.2 p -33.78 -38.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.0 p -131.29 -36.71 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.156 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . 0.412 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 140.3 -39.07 1.52 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.483 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . 0.438 ' CG ' ' N ' ' A' ' 469' ' ' CYS . 21.2 t-20 -107.79 168.18 9.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . 0.438 ' N ' ' CG ' ' A' ' 468' ' ' ASN . 17.7 t -120.9 150.3 41.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.3 tp -76.02 -36.49 31.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.112 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -52.6 -61.79 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 138.61 -156.64 24.26 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.99 -39.63 87.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.755 0.312 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.67 63.71 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -79.06 144.47 34.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.89 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 3.9 ppp? -55.71 -24.2 33.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.875 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 33.5 m-85 -104.28 160.14 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.884 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.4 m -80.04 145.87 32.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.898 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -111.55 22.58 14.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . 0.411 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 71.1 m-20 -58.41 156.35 22.81 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.627 0.727 . . . . 0.0 110.83 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.4 Cg_endo -69.74 112.1 2.99 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.716 2.278 . . . . 0.0 112.358 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 18.2 mt -39.72 129.37 2.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.93 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 7.2 p -102.63 -179.94 4.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.11 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . 0.445 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 0.2 OUTLIER -70.41 -30.83 67.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.445 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 12.7 pt-20 -79.0 -42.33 26.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.917 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.9 p -68.57 -50.85 48.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.132 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.38 -31.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.12 -41.38 74.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.489 ' N ' ' O ' ' A' ' 486' ' ' THR . 49.9 mt -53.56 -66.06 0.46 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 91.8 mt -39.93 -56.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -39.69 -41.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 496' ' ' ASP . 1.7 tppp? -80.09 -42.76 22.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -59.6 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 58.7 mt -49.1 -56.47 9.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.27 71.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . 0.4 ' CG ' ' O ' ' A' ' 492' ' ' LYS . 64.1 m-20 -43.68 -48.92 7.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.401 ' O ' ' C ' ' A' ' 498' ' ' ALA . 6.0 t70 -78.71 -61.93 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.865 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.401 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -36.3 -50.48 0.75 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -46.04 -57.74 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.46 -54.71 16.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.113 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.17 -122.6 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.491 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -168.1 130.33 1.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 111.128 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -120.44 105.75 11.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -98.31 174.43 6.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -132.98 176.39 8.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -158.1 133.64 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.908 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -146.77 109.43 4.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.84 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -75.79 92.24 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.168 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.48 149.9 7.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -75.81 174.2 10.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.432 ' O ' ' C ' ' A' ' 512' ' ' LYS . 1.8 pt? -116.75 42.08 2.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 511' ' ' LEU . 50.2 mttt 35.22 42.07 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.915 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 512' ' ' LYS . 7.5 ttpt -35.53 140.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.935 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 70.0 m -146.18 170.64 16.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -141.29 130.33 4.4 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.488 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -48.51 0.71 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.702 2.268 . . . . 0.0 112.322 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.2 t 55.65 41.29 30.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.849 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.3 t -92.7 169.28 10.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.843 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 CA-C-O 119.147 -0.807 . . . . 0.0 112.464 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.455 -0.258 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 27.5 m -127.09 109.89 12.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.914 0.388 . . . . 0.0 110.854 -179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 1.9 t -42.26 153.79 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 120.41 121.6 2.89 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 1.1 t 56.97 41.06 28.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.908 0.385 . . . . 0.0 110.872 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 38.8 m -90.29 174.63 7.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.837 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 156.34 164.59 13.55 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.503 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -119.59 177.43 4.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 73.9 mt -138.14 144.36 43.09 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.595 0.712 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -168.23 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.714 2.276 . . . . 0.0 112.331 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 16.1 mmtm 52.85 25.24 3.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.93 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 452' ' ' PRO . 56.2 mttt -38.37 132.54 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 2.8 tpp85 -89.15 63.75 6.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -139.17 144.08 38.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.854 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.572 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 35.6 tp -61.95 132.5 53.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . 0.436 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 7.0 t -67.06 137.79 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -77.48 -7.28 55.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.91 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -109.54 -44.12 3.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.462 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 39.2 t80 -48.13 -34.66 10.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.905 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 441' ' ' ILE . 63.5 mt -43.48 -32.9 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.129 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 p -99.51 -33.8 10.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.139 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.01 -10.58 13.58 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.501 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -100.43 98.99 9.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.865 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 37.6 t -136.42 109.47 7.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.51 -59.31 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.419 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 7.8 mtm105 -80.49 107.16 13.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.18 -77.61 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -82.43 -10.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -99.45 15.61 25.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.891 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 35.8 t -80.42 111.72 25.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.1 Cg_endo -69.75 3.21 2.9 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.64 2.227 . . . . 0.0 112.368 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -105.35 -175.11 2.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 40.3 mmm -100.74 136.52 40.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.899 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.462 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 24.8 m170 -118.13 -75.24 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.74 -65.3 1.78 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.516 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 456' ' ' GLY . 8.3 m-20 -33.44 -47.26 0.21 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.826 0.346 . . . . 0.0 110.847 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.572 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 17.2 t80 -43.46 130.3 3.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.64 0.734 . . . . 0.0 110.845 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . 0.486 ' CB ' HD23 ' A' ' 482' ' ' LEU . 53.7 Cg_endo -69.81 146.25 59.34 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.685 2.257 . . . . 0.0 112.345 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.533 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 45.4 t -70.19 146.14 50.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.885 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -79.64 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 464' ' ' HIS . 35.2 mt -45.41 -59.77 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.958 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -40.91 -22.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 28.5 m-70 -100.19 -54.96 2.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.47 ' C ' ' O ' ' A' ' 464' ' ' HIS . 71.8 p -31.17 -41.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.136 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.408 ' N ' ' O ' ' A' ' 464' ' ' HIS . 77.8 p -128.75 -36.78 1.8 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.114 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 137.9 -38.07 1.75 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.476 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -106.72 174.32 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.866 0.365 . . . . 0.0 110.852 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.8 t -133.17 128.7 36.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.4 tp -72.11 -26.63 25.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -49.59 -43.52 46.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.15 -169.59 23.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.6 -29.48 51.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.773 0.321 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -100.67 44.33 1.02 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 47.7 t -51.17 144.27 9.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.513 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 5.1 ppp? -65.42 -17.35 64.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.513 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 17.8 m-85 -102.81 159.44 15.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 29.1 m -80.13 132.41 35.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -100.8 23.5 10.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.77 159.51 52.94 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.612 0.72 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 110.79 2.65 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.671 2.247 . . . . 0.0 112.332 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.486 HD23 ' CB ' ' A' ' 459' ' ' PRO . 24.9 mt -40.16 131.5 2.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.8 p -99.59 169.63 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.14 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -56.2 -30.98 63.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -81.41 -55.47 4.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.403 ' HA ' ' CD1' ' A' ' 489' ' ' LEU . 47.6 p -55.32 -37.95 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.119 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -41.84 63.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -65.28 -33.39 75.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.403 ' CD1' ' HA ' ' A' ' 486' ' ' THR . 62.9 mt -59.39 -65.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 493' ' ' MET . 40.6 mt -40.13 -61.57 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -39.95 -41.91 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -79.94 -31.02 40.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' MET . . . . . 0.467 ' N ' ' O ' ' A' ' 490' ' ' LEU . 14.0 tmm? -63.32 -59.4 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.4 mp -43.23 -46.69 6.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.886 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -68.8 -53.32 22.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.136 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -49.43 -38.35 29.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.884 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.51 -55.57 19.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . 0.475 ' O ' ' N ' ' A' ' 500' ' ' ALA . . . -66.57 -64.3 0.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . 0.421 ' C ' ' O ' ' A' ' 498' ' ' ALA . 1.6 pp20? -35.97 -31.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 498' ' ' ALA . . . -85.3 47.56 1.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.124 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . 0.44 ' C ' ' O ' ' A' ' 500' ' ' ALA . . . 34.41 89.58 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.504 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -51.0 114.3 1.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.82 0.343 . . . . 0.0 111.111 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.4 172.0 7.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.826 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -122.94 167.02 14.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.863 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -143.21 163.4 33.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.879 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -147.64 168.12 22.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.861 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -162.11 149.77 14.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 86.6 t -129.84 125.06 60.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.115 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -83.26 167.58 17.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.896 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -100.76 157.05 16.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.927 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.503 ' CD1' ' O ' ' A' ' 511' ' ' LEU . 3.6 pp -103.2 50.3 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 41.9 tttm 40.2 46.58 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.85 116.94 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.909 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 13.7 t -174.95 148.97 1.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.863 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -119.1 113.98 2.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.474 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 171.0 15.25 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.722 2.281 . . . . 0.0 112.333 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 4.6 m -156.64 176.54 12.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' SER . . . . . 0.437 ' O ' ' C ' ' A' ' 519' ' ' GLY . 17.6 m 61.4 42.45 11.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.892 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 518' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.097 -0.835 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 23.1 t -62.89 155.28 27.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 90.6 p -95.35 147.34 23.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.879 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -91.56 147.64 18.9 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.507 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 6.2 t -114.69 114.86 26.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.852 0.358 . . . . 0.0 110.868 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 1.7 m -136.55 121.77 19.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -115.44 177.24 17.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.421 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 430' ' ' LEU . 61.3 mm-40 -113.34 153.1 29.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 110.9 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' A' ' 429' ' ' GLU . 53.6 mt -35.33 153.37 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.629 0.728 . . . . 0.0 110.904 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.73 75.74 1.18 Allowed 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.721 2.281 . . . . 0.0 112.36 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 42.0 mmtt -152.63 -179.14 7.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -135.8 101.57 4.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.943 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . 0.468 ' HB2' ' CD2' ' A' ' 489' ' ' LEU . 0.0 OUTLIER -83.08 35.12 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -115.37 154.59 28.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.448 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 52.4 tp -65.04 117.78 8.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.921 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . 0.461 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.1 t -50.66 116.99 2.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -60.23 -11.51 6.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -100.54 -48.68 4.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.49 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 42.3 t80 -47.09 -36.55 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 64.6 mt -40.05 -35.31 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.157 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 20.2 p -100.4 -33.45 10.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.56 -8.68 15.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.508 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.01 94.1 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 4.5 t -132.68 106.91 8.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.21 -67.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 25.0 mtm-85 -67.07 101.62 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.51 -75.11 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.072 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -81.34 -6.62 59.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -112.6 23.54 13.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.0 t -73.95 114.77 35.93 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.609 0.719 . . . . 0.0 110.925 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -5.92 17.36 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.68 2.254 . . . . 0.0 112.358 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -106.59 -173.54 2.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.1 mmm -99.63 148.55 24.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.916 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . 0.49 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 23.9 m170 -126.3 -76.68 0.58 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.837 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' N ' ' A' ' 458' ' ' PHE . . . -80.91 -65.28 1.72 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.475 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.2 m-20 -33.98 -35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.45 ' N ' ' O ' ' A' ' 456' ' ' GLY . 16.3 t80 -56.79 124.9 66.57 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.665 0.745 . . . . 0.0 110.836 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 135.08 29.66 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 2.271 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 7.4 t -57.68 147.74 26.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.837 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -80.27 -68.16 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 464' ' ' HIS . 25.6 mt -45.52 -58.19 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.929 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -41.22 -23.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.4 m-70 -99.91 -51.41 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 80.8 p -33.11 -48.14 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 50.5 p -123.36 -32.32 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.167 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.22 -38.57 1.84 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.479 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -105.58 156.96 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.889 0.376 . . . . 0.0 110.873 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 11.4 t -117.3 130.82 56.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.872 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.8 tp -57.21 -29.3 31.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.143 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -56.75 -63.53 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.23 -148.26 19.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.501 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -76.31 -38.44 56.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.803 0.335 . . . . 0.0 110.827 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -100.4 63.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 51.9 t -78.86 147.61 33.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.4 ppp? -59.43 -23.59 62.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 25.0 m-85 -103.53 161.29 14.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 59.2 m -80.24 141.07 35.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.833 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 47.3 m170 -108.89 29.34 7.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.34 152.86 93.78 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.642 0.734 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.81 116.37 4.53 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 0.0 112.33 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 40.2 mt -40.06 147.54 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.2 p -129.74 155.46 45.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.11 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . 0.411 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 3.5 pm0 -39.38 -31.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . 0.411 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 6.0 tm-20 -80.36 -73.99 0.33 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.429 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.7 p -47.61 -49.61 26.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.151 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -43.5 1.39 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -59.71 -41.82 91.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.468 ' CD2' ' HB2' ' A' ' 434' ' ' ARG . 31.5 mt -51.08 -64.79 0.7 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 493' ' ' MET . 44.6 mt -40.62 -59.45 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -39.08 -37.31 0.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -38.91 30.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.925 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' MET . . . . . 0.437 ' N ' ' O ' ' A' ' 490' ' ' LEU . 12.1 tmm? -62.8 -58.75 6.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.825 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -46.99 -54.69 9.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.92 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.67 -40.68 95.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.115 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -59.59 -62.28 1.99 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.841 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -59.1 -60.22 4.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -39.61 -53.44 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.071 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.39 -60.99 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.907 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -78.58 89.28 4.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -102.23 -178.35 27.56 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.506 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -65.58 167.58 8.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 71.36 42.26 0.7 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.934 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -134.97 156.13 49.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -125.67 149.75 48.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -125.13 121.45 34.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -164.93 105.39 0.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.86 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.3 p -104.77 114.35 44.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.106 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -65.53 132.93 50.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.903 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -91.46 36.37 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.522 ' O ' ' C ' ' A' ' 512' ' ' LYS . 13.3 mt 43.54 51.76 6.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . 0.522 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER 28.15 43.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.887 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 511' ' ' LEU . 4.7 tppp? -37.39 123.61 0.96 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 5.2 t -169.64 165.38 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.851 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 167.26 95.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.494 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 168.61 21.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.664 2.243 . . . . 0.0 112.367 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 54.1 p -162.34 143.57 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.89 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.5 t -167.58 164.61 14.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.873 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 CA-C-O 119.178 -0.79 . . . . 0.0 112.488 -179.998 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.462 -0.255 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 424' ' ' SER . 23.0 t -170.96 140.12 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.876 0.37 . . . . 0.0 110.842 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 423' ' ' SER . 23.3 t -36.91 151.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.853 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 75.19 -142.16 28.98 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.514 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 81.2 p -130.72 159.57 36.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 110.826 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 61.0 p -54.35 173.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -117.54 170.68 13.62 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.444 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -88.56 104.03 16.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.881 0.372 . . . . 0.0 110.903 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.5 164.66 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.603 0.716 . . . . 0.0 110.89 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 79.79 0.92 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.665 2.244 . . . . 0.0 112.323 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 35.3 mmtt -154.16 152.03 29.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' LYS . . . . . 0.448 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 17.0 mttm -122.34 135.56 54.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.885 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 38.5 mmm-85 -109.17 39.49 2.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -112.25 151.09 30.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' LEU . . . . . 0.466 HD12 ' CD2' ' A' ' 458' ' ' PHE . 14.8 tp -63.77 124.12 20.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.926 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 37.8 t -67.75 139.47 56.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -79.57 4.75 14.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -109.12 -53.61 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.878 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' TYR . . . . . 0.463 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 22.1 t80 -46.89 -39.99 13.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 53.4 mt -40.54 -37.98 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.097 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.7 p -101.7 -35.94 8.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.156 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.02 -9.96 13.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -99.06 87.62 3.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.892 0.377 . . . . 0.0 110.886 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.4 t -125.01 103.6 8.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.71 -59.08 1.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.174 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' ARG . . . . . 0.406 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.7 mtt180 -81.98 107.52 14.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -79.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -82.6 8.5 11.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -108.34 -12.67 15.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 14.6 t -65.77 111.26 5.92 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.615 0.722 . . . . 0.0 110.893 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 2.99 3.05 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.64 2.227 . . . . 0.0 112.342 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' TYR . . . . . 0.448 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 80.3 m-85 -100.1 176.1 5.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 32.1 mmm -91.86 140.66 29.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.866 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -117.81 -77.25 0.57 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.464 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.84 -66.98 1.58 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' A' ' 456' ' ' GLY . 25.2 m-20 -32.58 -43.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . 0.466 ' CD2' HD12 ' A' ' 436' ' ' LEU . 19.2 t80 -45.52 130.31 6.33 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.626 0.727 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 144.3 53.79 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 0.0 112.322 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' CYS . . . . . 0.492 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 20.1 t -65.71 141.95 58.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 72.3 tttt -75.91 -66.74 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.0 mt -44.67 -58.64 2.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -39.37 -25.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' HIS . . . . . 0.544 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 48.2 m-70 -100.58 -53.14 3.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' THR . . . . . 0.474 ' C ' ' O ' ' A' ' 464' ' ' HIS . 56.0 p -31.38 -42.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.149 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 46.5 p -129.49 -32.92 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.149 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.95 -41.35 1.5 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.49 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -103.72 150.47 24.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.922 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 471' ' ' ASN . 53.3 t -110.69 99.9 8.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.87 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' ILE . . . . . 0.425 ' O ' ' CG2' ' A' ' 470' ' ' ILE . 8.1 tp -80.51 38.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 469' ' ' CYS . 30.2 m-20 -95.76 -54.73 3.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 170.11 154.32 9.3 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -47.42 -47.54 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.819 0.342 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -100.92 55.53 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -42.06 152.51 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' MET . . . . . 0.473 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 4.2 ppp? -77.31 -18.39 57.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.855 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.473 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.7 m-85 -105.72 158.93 16.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.862 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 67.5 m -80.1 144.81 32.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.852 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -108.12 31.87 5.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.75 158.07 81.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.602 0.715 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 134.49 28.12 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.688 2.259 . . . . 0.0 112.377 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.544 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 44.7 mt -62.13 137.03 58.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 69.1 p -119.9 152.55 37.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.125 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -40.03 -29.23 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.71 -75.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.838 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.45 ' O ' ' N ' ' A' ' 489' ' ' LEU . 48.6 p -46.9 -47.96 21.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.116 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' ARG . . . . . 0.405 ' N ' ' HG1' ' A' ' 486' ' ' THR . 4.4 tpt180 -40.34 -41.09 1.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -64.18 -39.27 93.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.946 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 486' ' ' THR . 79.1 mt -48.08 -67.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.87 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 60.7 mt -41.26 -57.18 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -39.96 -42.44 1.36 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.88 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -79.79 -44.61 20.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.882 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.4 tmm? -54.89 -59.29 4.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.869 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' LEU . . . . . 0.407 ' N ' HD12 ' A' ' 494' ' ' LEU . 9.9 mp -50.64 -60.83 2.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -43.88 -42.51 5.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -69.22 -59.61 2.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' A' ' 500' ' ' ALA . 9.6 m-20 -57.99 -64.46 0.9 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -38.14 -64.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.103 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.83 -42.91 80.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -114.03 99.27 7.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.056 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . 0.43 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . 141.72 -74.99 0.34 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.463 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . -35.7 115.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.756 0.313 . . . . 0.0 111.083 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -81.49 44.98 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 40.78 40.46 0.97 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.2 134.38 42.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.2 148.94 29.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.89 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -39.86 138.39 0.79 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.85 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.1 p -122.83 34.55 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.132 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -172.82 173.65 3.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -81.81 112.64 19.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.895 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.453 ' CD1' ' O ' ' A' ' 511' ' ' LEU . 4.1 pp -81.2 41.52 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.951 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 29.5 mtmt 61.13 42.52 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -32.39 34.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 4.5 t -100.89 102.12 13.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.846 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -170.23 -100.82 0.14 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.474 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 151.95 69.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.721 2.281 . . . . 0.0 112.34 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 24.9 p -59.6 126.76 28.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.876 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 3.5 m -57.03 117.09 3.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.856 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 CA-C-O 119.181 -0.788 . . . . 0.0 112.484 -179.971 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 18.4 mmtp . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.403 ' O ' HD22 ' A' ' 489' ' ' LEU . 0.0 OUTLIER -100.15 43.01 1.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.86 -180.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 435' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 436' ' ' LEU . 51.3 tp10 -114.52 162.54 16.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.916 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.454 ' N ' ' HG3' ' A' ' 435' ' ' GLU . 26.4 tp -74.65 104.72 5.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 34.9 t -42.41 135.3 2.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.477 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -71.1 -5.6 32.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.925 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -105.48 -49.4 3.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.555 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 40.6 t80 -43.27 -35.42 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -44.11 -39.1 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 58.6 p -100.32 -37.78 8.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.04 -4.52 18.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' PHE . . . . . 0.476 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 9.2 t80 -99.54 77.65 2.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.23 107.37 15.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.888 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.41 -59.0 1.41 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.102 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -84.77 111.12 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.14 -76.85 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.062 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -81.56 -5.21 57.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -99.4 6.83 45.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.869 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 44.8 t -80.09 111.41 21.79 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 1.5 4.34 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.692 2.261 . . . . 0.0 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -102.05 179.6 4.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 18.9 mmm -95.48 143.32 26.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.93 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.555 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 21.9 m170 -120.51 -77.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.18 -63.2 1.9 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.52 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.8 m-20 -34.0 -46.65 0.24 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.789 0.328 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -43.17 129.36 3.42 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.591 0.71 . . . . 0.0 110.907 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 146.03 59.04 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.3 t -69.01 145.28 53.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.88 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.406 ' O ' HG23 ' A' ' 465' ' ' THR . 29.4 tttp -80.09 -65.6 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.1 mt -44.73 -58.64 2.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -39.61 -25.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.49 ' N ' ' O ' ' A' ' 462' ' ' LEU . 27.9 m170 -100.29 -52.46 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.855 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 464' ' ' HIS . 70.7 p -31.61 -45.31 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.15 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 76.7 p -126.01 -34.66 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.89 -37.69 1.98 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.499 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -108.58 140.73 41.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 110.866 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.3 t -100.55 135.18 42.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 471' ' ' ASN . 5.6 tp -61.2 -42.03 91.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.156 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 471' ' ' ASN . . . . . 0.438 ' N ' HG23 ' A' ' 470' ' ' ILE . 31.6 m-20 -51.84 -57.48 9.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 116.12 -149.0 18.88 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -75.76 -16.03 60.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 110.866 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.18 44.41 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.832 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 t -79.48 147.96 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.572 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.3 ppp? -76.14 -11.15 59.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.572 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.3 m-85 -107.96 160.19 15.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 74.8 m -77.77 143.48 37.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -114.73 31.79 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.841 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -72.87 159.43 85.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.606 0.717 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 120.86 7.58 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.687 2.258 . . . . 0.0 112.37 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 27.1 mt -42.99 148.51 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.7 p -131.11 154.77 47.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.156 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -39.95 -31.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -80.01 -74.13 0.32 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 70.1 p -42.83 -46.33 5.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.18 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.16 -46.5 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -55.9 -38.33 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.837 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 434' ' ' ARG . 34.7 mt -53.03 -65.86 0.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.921 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 84.3 mt -40.64 -56.6 2.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -39.95 -43.36 1.51 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.15 -59.94 2.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -41.41 -59.4 1.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.868 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.464 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 24.2 mttm . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.79 0.329 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.526 ' HB3' HD23 ' A' ' 489' ' ' LEU . 0.2 OUTLIER -120.53 48.34 1.62 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -139.47 154.66 47.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.524 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 14.5 tp -70.16 143.26 52.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 22.6 t -74.11 146.69 43.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.892 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.484 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.2 OUTLIER -77.35 -12.5 59.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.912 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -104.49 -48.36 3.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.504 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 37.7 t80 -42.94 -36.38 1.52 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.941 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 441' ' ' ILE . . . . . 0.474 HG12 HD21 ' A' ' 436' ' ' LEU . 79.2 mt -40.1 -36.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.76 -34.68 10.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.96 -9.03 21.25 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -98.86 81.93 2.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.821 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.1 t -118.26 100.32 7.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.06 -59.61 1.43 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.103 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -74.46 96.19 2.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.18 -76.34 0.23 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.145 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.56 20.3 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' ASN . . . . . 0.533 ' O ' ' ND2' ' A' ' 450' ' ' ASN . 0.2 OUTLIER -124.98 -1.32 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.2 t -80.16 111.24 20.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.644 0.735 . . . . 0.0 110.925 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 0.26 5.88 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.664 2.243 . . . . 0.0 112.348 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.464 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 78.5 m-85 -100.01 175.69 5.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 48.8 mmm -90.09 143.34 26.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.898 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.504 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 22.2 m170 -120.03 -75.85 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.28 -68.15 1.5 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.467 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.452 ' C ' ' O ' ' A' ' 456' ' ' GLY . 5.9 m-20 -34.5 -35.53 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.844 0.354 . . . . 0.0 110.862 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 20.7 t80 -51.81 124.05 26.45 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.663 0.744 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 140.99 43.87 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.721 2.281 . . . . 0.0 112.291 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.36 142.12 55.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.415 ' O ' HG23 ' A' ' 465' ' ' THR . 78.6 tttt -76.81 -65.59 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.885 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.9 mt -44.99 -58.25 3.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -40.72 -23.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.564 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.9 m-70 -100.37 -51.49 3.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.878 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.464 ' C ' ' O ' ' A' ' 464' ' ' HIS . 49.0 p -31.37 -40.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 464' ' ' HIS . 75.6 p -132.93 -32.75 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.53 -34.81 2.3 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -110.0 149.21 30.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 15.0 t -104.24 151.43 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.1 tp -79.33 -37.13 18.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.112 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -49.89 -65.94 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 139.67 -169.39 24.64 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.527 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.19 -24.54 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.35 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -104.9 46.92 0.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.75 147.62 47.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.528 ' SD ' ' CE1' ' A' ' 477' ' ' PHE . 5.2 ppp? -79.67 11.74 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.851 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.528 ' CE1' ' SD ' ' A' ' 476' ' ' MET . 14.0 m-85 -123.07 155.71 36.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 8.0 m -75.36 127.09 32.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -103.03 16.12 27.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.03 156.44 74.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.647 0.737 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 121.26 7.94 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.687 2.258 . . . . 0.0 112.342 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.564 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 59.3 mt -41.49 144.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.921 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 485' ' ' GLU . 4.4 p -138.11 158.12 44.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.162 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -38.69 -29.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 483' ' ' THR . 32.4 mt-10 -81.24 -75.77 0.27 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 489' ' ' LEU . 68.1 p -50.03 -47.52 53.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.139 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.09 -36.5 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -65.21 -41.61 94.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 434' ' ' ARG . 87.8 mt -46.9 -62.61 1.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 66.4 mt -40.32 -57.12 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -42.54 -38.24 1.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.853 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.98 -52.37 8.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.5 -60.83 2.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.932 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 25.0 mttm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.762 0.315 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.45 ' HB3' HD22 ' A' ' 489' ' ' LEU . 7.6 mpt_? -105.53 44.67 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -113.71 152.17 30.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.897 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 37.4 tp -63.12 114.63 3.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.976 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.71 131.99 52.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.91 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 15.47 1.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.41 -37.11 3.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.438 ' CZ ' ' HE2' ' A' ' 476' ' ' MET . 34.9 t80 -68.09 -35.9 78.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.88 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.0 mt -43.19 -33.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.5 p -102.08 -36.47 8.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 120.09 -10.15 11.05 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 444' ' ' PHE . . . . . 0.418 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 8.2 t80 -99.65 85.86 3.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.871 0.367 . . . . 0.0 110.913 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.1 t -121.16 110.49 16.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.56 -70.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.095 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -78.59 107.73 11.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.844 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -75.32 0.26 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.7 2.99 23.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -114.35 15.78 17.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.413 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 36.8 t -80.59 111.2 20.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.646 0.736 . . . . 0.0 110.864 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.6 Cg_endo -69.7 -0.88 7.5 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.694 2.263 . . . . 0.0 112.367 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -101.88 179.76 4.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 34.4 mmm -99.98 139.29 35.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 26.2 m170 -113.17 -78.34 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.13 -63.12 1.91 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.507 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 42.6 t0 -32.71 -45.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.828 0.346 . . . . 0.0 110.926 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -46.91 124.59 8.15 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.608 0.718 . . . . 0.0 110.892 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 145.95 58.82 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.704 2.269 . . . . 0.0 112.333 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.5 t -64.48 144.41 57.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.843 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.457 ' O ' HG23 ' A' ' 465' ' ' THR . 24.2 ttpt -79.33 -67.15 0.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.1 mt -44.63 -59.17 2.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -39.67 -25.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.479 ' N ' ' O ' ' A' ' 462' ' ' LEU . 29.9 m170 -99.89 -51.72 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 461' ' ' LYS . 44.5 p -35.58 -44.38 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.195 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 68.3 p -123.35 -35.03 3.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.37 -37.65 1.96 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.489 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -109.96 147.74 32.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.86 0.362 . . . . 0.0 110.855 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 38.2 t -103.2 147.56 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.879 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.443 HG23 ' N ' ' A' ' 471' ' ' ASN . 4.5 tp -70.6 -42.36 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 471' ' ' ASN . . . . . 0.443 ' N ' HG23 ' A' ' 470' ' ' ILE . 8.0 t-20 -51.91 -54.71 26.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 121.63 -153.24 16.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.434 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.44 -19.15 59.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.321 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -101.41 42.7 1.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.95 143.61 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.438 ' HE2' ' CZ ' ' A' ' 440' ' ' TYR . 5.3 ppp? -80.93 19.32 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.415 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 26.3 m-85 -126.38 158.61 35.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.882 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 13.2 m -76.47 120.29 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -100.84 32.66 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.821 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -77.71 161.51 71.45 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.588 0.709 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 116.93 4.79 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.712 2.275 . . . . 0.0 112.311 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.624 HD13 ' HG2' ' A' ' 487' ' ' ARG . 28.6 mt -40.98 150.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.2 p -133.27 154.92 50.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.154 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -40.48 -33.26 0.25 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -80.16 -74.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.521 ' HA ' HD12 ' A' ' 489' ' ' LEU . 32.1 p -46.95 -52.98 13.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.624 ' HG2' HD13 ' A' ' 482' ' ' LEU . 0.0 OUTLIER -40.96 -44.55 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -59.64 -38.29 80.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 486' ' ' THR . 55.0 mt -52.21 -65.54 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.936 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 78.1 mt -42.25 -57.59 2.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -39.89 -42.31 1.31 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -79.53 -48.32 14.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.913 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -51.5 -58.76 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.925 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.782 0.325 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -123.62 46.21 2.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -114.45 165.72 12.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.562 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 27.2 tp -71.71 115.92 11.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.54 125.22 22.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -66.26 -3.76 6.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -100.08 -55.36 2.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.559 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 10.2 t80 -43.91 -36.36 2.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 39.5 mt -43.74 -38.44 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -35.02 9.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.53 -9.78 11.64 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -99.73 96.16 7.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.891 0.377 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 36.5 t -130.64 102.16 6.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.095 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -67.69 82.71 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -78.73 -57.47 3.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.058 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.88 -2.03 31.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.956 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 36.0 m-20 -134.85 37.49 3.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 53.2 t -80.76 111.04 19.87 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 110.896 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.4 Cg_endo -69.71 -2.5 10.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.712 2.275 . . . . 0.0 112.342 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -108.31 -177.24 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.893 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 38.3 mmm -100.26 147.78 25.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 23.4 m170 -122.57 -77.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.438 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.68 -65.73 1.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.488 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.4 m-20 -34.73 -39.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.562 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.7 t80 -50.44 124.59 18.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 0.0 110.826 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 141.08 44.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.339 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.0 t -65.9 141.07 58.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -78.01 -66.8 0.8 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.884 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.1 mt -45.37 -56.67 4.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -40.81 -24.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.502 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 40.9 m-70 -100.61 -53.66 3.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.862 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 464' ' ' HIS . 69.8 p -31.1 -41.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.15 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.431 ' N ' ' O ' ' A' ' 464' ' ' HIS . 39.2 p -129.81 -36.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 136.22 -37.85 1.84 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -106.66 142.74 35.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -100.51 144.45 29.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.6 tp -71.9 -36.57 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.149 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -52.21 -60.03 3.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.921 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 125.72 -156.01 19.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.512 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -71.97 -27.59 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 110.89 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -101.47 44.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -73.91 146.48 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.1 ppp? -80.6 17.52 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 25.4 m-85 -128.23 154.81 45.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.9 m -78.55 126.9 31.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -100.11 19.2 16.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.86 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.28 155.14 58.89 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.596 0.712 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 116.17 4.43 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.74 2.293 . . . . 0.0 112.324 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.623 HD11 ' CD1' ' A' ' 490' ' ' LEU . 12.7 mt -40.61 132.41 2.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.52 ' O ' ' CB ' ' A' ' 487' ' ' ARG . 69.2 p -112.71 167.13 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -49.61 -31.86 11.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -81.26 -77.0 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.885 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 49.9 p -45.62 -36.94 5.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.152 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 483' ' ' THR . 12.5 tpt180 -48.71 -40.92 30.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.859 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -61.45 -45.76 92.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 45.1 mt -41.41 -67.01 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.623 ' CD1' HD11 ' A' ' 482' ' ' LEU . 77.4 mt -40.78 -59.41 1.41 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -39.7 -41.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.87 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -79.63 -50.58 10.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.3 tmm? -57.93 -62.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.926 179.967 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.5 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 3.7 mmmp? . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.791 0.329 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 489' ' ' LEU . 5.7 tpt180 61.01 40.98 14.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -135.12 160.86 37.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.561 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 43.6 tp -60.75 112.92 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 437' ' ' CYS . . . . . 0.5 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 5.9 t -53.24 115.49 1.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -56.03 -12.18 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -101.0 -48.46 4.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.5 ' CB ' ' HB3' ' A' ' 437' ' ' CYS . 25.1 t80 -45.38 -40.75 8.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 54.1 mt -39.95 -31.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.116 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 81.7 p -102.15 -36.6 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.44 11.68 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.487 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -96.96 88.53 4.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.907 0.384 . . . . 0.0 110.848 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 12.6 t -126.37 110.49 13.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.76 -72.05 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.067 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 64.5 mtt180 -73.63 102.41 3.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.1 -72.14 0.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.112 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -76.43 -7.33 54.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.892 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.93 30.26 7.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.892 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 44.7 t -73.97 113.39 22.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.725 . . . . 0.0 110.865 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.3 Cg_endo -69.77 7.11 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.26 . . . . 0.0 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.5 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 49.3 m-85 -118.38 -175.23 2.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 27.4 mmm -101.15 134.85 43.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.425 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.5 m170 -113.58 -76.66 0.58 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.829 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.499 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -77.97 -70.64 1.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.499 ' C ' ' O ' ' A' ' 456' ' ' GLY . 2.6 m-20 -29.54 -42.84 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 0.0 110.862 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.561 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 17.9 t80 -48.16 125.84 11.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.668 0.747 . . . . 0.0 110.866 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 126.99 13.97 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.38 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.424 ' HG ' ' HD2' ' A' ' 477' ' ' PHE . 6.7 t -49.88 149.42 2.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.839 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -80.11 -67.9 0.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.504 ' O ' ' N ' ' A' ' 464' ' ' HIS . 48.0 mt -43.78 -60.42 1.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.422 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 92.4 t80 -39.22 -25.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.504 ' N ' ' O ' ' A' ' 462' ' ' LEU . 17.2 m170 -99.0 -53.23 3.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 73.4 p -32.61 -43.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.142 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 82.7 p -127.37 -35.92 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.153 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.422 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.02 -40.42 1.45 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -105.04 172.65 6.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.3 t -129.56 119.18 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.905 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -51.94 -30.27 12.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -50.45 -63.35 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 143.57 -162.44 27.67 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.528 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.1 -37.6 75.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.864 0.364 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -99.88 65.14 1.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.887 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 20.9 t -78.18 151.88 32.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.8 ppp? -69.86 -19.41 63.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 20.5 m-85 -101.46 155.99 17.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 35.1 m -78.66 142.92 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.853 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -115.18 35.15 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.22 161.17 80.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.596 0.712 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 116.5 4.59 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.645 2.23 . . . . 0.0 112.348 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 30.0 mt -40.53 146.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.914 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 77.3 p -125.26 156.25 38.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.126 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -40.42 -33.57 0.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -80.46 -75.21 0.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.614 ' HA ' HD12 ' A' ' 489' ' ' LEU . 20.3 p -41.17 -49.52 3.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.18 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -46.92 2.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.97 -45.98 91.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 434' ' ' ARG . 80.7 mt -45.4 -62.24 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.946 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 38.8 mt -41.86 -61.31 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.906 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.8 -47.6 2.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -68.4 -43.47 77.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' MET . . . . . 0.443 ' CE ' HD22 ' A' ' 494' ' ' LEU . 14.5 tmm? -56.92 -60.34 3.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.443 HD22 ' CE ' ' A' ' 493' ' ' MET . 4.0 mm? . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.46 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 26.2 mmmt . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.755 ' O ' HD22 ' A' ' 489' ' ' LEU . 16.7 tpp180 60.64 35.74 19.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -128.02 176.31 7.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 33.8 tp -75.39 121.87 22.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.962 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 437' ' ' CYS . . . . . 0.45 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.2 t -59.82 131.38 50.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.889 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 2.05 7.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -119.0 -40.56 2.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.455 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 34.5 t80 -54.46 -28.37 43.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.8 mt -45.57 -32.4 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 p -102.31 -29.7 11.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.19 -10.33 17.57 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.497 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -99.98 97.95 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.848 0.356 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 11.6 t -131.63 108.01 9.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.896 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.65 -66.19 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.096 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 19.2 mtm-85 -71.19 104.89 3.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.861 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -77.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -81.7 -2.79 51.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -114.11 24.6 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.3 t -80.18 114.54 47.72 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.873 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.68 3.34 Favored 'Trans proline' 0 C--O 1.231 0.13 0 C-N-CA 122.675 2.25 . . . . 0.0 112.369 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.46 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 75.6 m-85 -115.53 -174.37 2.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 31.8 mmm -100.03 150.19 22.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.877 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.455 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 30.3 m170 -125.65 -77.21 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -81.13 -60.09 2.32 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.465 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -39.32 -43.46 1.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 20.3 t80 -46.61 127.7 8.21 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.662 0.744 . . . . 0.0 110.903 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 140.27 42.14 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.7 146.34 49.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.584 ' NZ ' HD23 ' A' ' 494' ' ' LEU . 34.4 tttp -80.14 -68.72 0.65 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.902 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.7 mt -44.89 -56.85 4.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.443 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 44.7 t80 -40.0 -27.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.554 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 32.5 m-70 -98.63 -52.69 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 461' ' ' LYS . 31.9 p -34.21 -35.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 464' ' ' HIS . 76.8 p -132.74 -39.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.124 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.443 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.82 -38.99 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.501 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -109.14 152.16 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.859 0.362 . . . . 0.0 110.895 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 37.9 t -105.35 141.44 36.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.1 tp -72.91 -31.94 37.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -50.83 -68.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 144.45 -157.19 27.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.51 -29.06 61.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.779 0.323 . . . . 0.0 110.864 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.51 53.91 0.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.2 t -73.61 148.47 42.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.487 ' SD ' ' CZ ' ' A' ' 477' ' ' PHE . 4.4 ppp? -79.3 11.05 3.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.881 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.487 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 12.6 m-85 -124.59 158.1 33.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 2.8 m -76.8 134.02 39.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -109.33 20.27 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.826 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' ASP . . . . . 0.413 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 0.0 OUTLIER -67.79 158.92 81.63 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.601 0.715 . . . . 0.0 110.86 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 481' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.1 Cg_endo -69.73 117.85 5.33 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.672 2.248 . . . . 0.0 112.374 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.554 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 88.8 mt -39.29 140.1 0.46 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 12.1 p -120.44 154.56 35.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -41.1 -29.12 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -79.97 -75.56 0.25 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.89 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.2 p -46.25 -47.88 18.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.121 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -39.68 -39.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.25 -38.91 91.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 434' ' ' ARG . 84.2 mt -50.44 -61.66 2.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 57.1 mt -41.43 -55.72 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -39.71 -45.37 1.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.861 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.17 -36.87 39.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -65.27 -66.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.584 HD23 ' NZ ' ' A' ' 461' ' ' LYS . 16.2 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 49.5 mttp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.79 0.328 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.401 ' C ' ' CD ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -91.28 33.65 0.97 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -107.99 143.94 35.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.578 HD13 ' CD2' ' A' ' 458' ' ' PHE . 31.7 tp -66.98 120.66 14.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 33.3 t -59.12 134.02 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -79.37 12.08 2.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -117.71 -41.94 2.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -59.14 -33.41 70.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 70.6 mt -42.83 -33.0 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.4 p -101.48 -37.13 8.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.138 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.5 -8.42 17.58 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -100.13 80.97 2.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.897 0.38 . . . . 0.0 110.865 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 47.1 t -118.56 104.62 10.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.96 -64.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 79.3 mtt180 -78.21 105.56 9.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.852 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.42 -77.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.91 14.3 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.838 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -113.29 -17.25 12.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.856 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 8.0 t -65.95 111.21 5.9 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.552 0.692 . . . . 0.0 110.895 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 3.64 2.62 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.349 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -100.17 170.69 8.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 17.6 mmm -81.94 141.28 33.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -120.91 -77.61 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.8 -60.17 2.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.7 m-20 -34.45 -46.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.775 0.321 . . . . 0.0 110.832 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.578 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.6 t80 -46.65 126.21 8.09 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.664 0.745 . . . . 0.0 110.855 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 134.42 27.94 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.688 2.258 . . . . 0.0 112.331 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.4 t -53.16 145.19 14.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.484 ' O ' HG23 ' A' ' 465' ' ' THR . 21.0 tttm -80.12 -67.64 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.6 mt -44.76 -58.83 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.942 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.449 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 25.1 t80 -39.43 -25.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.96 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.516 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 30.4 m-70 -99.98 -54.15 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 461' ' ' LYS . 33.8 p -33.79 -40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 80.6 p -126.92 -33.18 2.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.127 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.449 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 131.81 -40.24 1.66 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.505 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -109.8 149.92 29.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 0.0 110.899 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.62 143.8 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.8 tp -71.34 -39.09 71.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.096 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.74 -68.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 141.58 -154.81 24.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.498 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -74.38 -24.49 59.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -101.69 49.27 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -79.26 148.08 32.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.522 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 3.6 ppp? -80.57 17.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.522 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 12.4 m-85 -129.43 157.38 42.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.5 p -80.07 128.68 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.877 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -103.87 21.94 15.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.46 158.67 86.26 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.614 0.721 . . . . 0.0 110.845 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 119.28 6.26 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.665 2.243 . . . . 0.0 112.387 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.516 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 39.8 mt -42.5 150.2 0.15 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.947 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.0 p -128.79 154.9 45.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.145 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -39.92 -30.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -80.66 -75.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 489' ' ' LEU . 20.7 p -46.99 -46.84 21.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.146 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -43.58 1.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -58.29 -40.5 82.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.937 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' A' ' 486' ' ' THR . 48.6 mt -49.87 -64.29 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 482' ' ' LEU . 85.2 mt -42.99 -54.0 4.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -41.38 -44.9 2.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -78.07 -59.18 2.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -44.19 -60.14 2.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.895 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 55.4 mt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 -179.995 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.82 0.343 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.465 ' CG ' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -105.67 47.59 0.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.844 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -124.82 143.7 50.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.881 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 458' ' ' PHE . 20.6 tp -73.59 102.65 3.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.89 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.8 t -40.02 124.1 1.76 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.883 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -68.05 -3.02 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -102.37 -51.52 3.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -47.78 -37.77 14.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.963 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.7 mt -41.17 -31.09 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.123 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 40.6 p -103.05 -33.93 9.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.94 -10.47 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.497 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -99.97 97.82 8.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 110.902 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.67 110.2 9.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.878 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.092 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.432 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 68.4 mtt180 -77.5 109.54 11.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.841 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.62 -77.16 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.125 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.74 5.8 17.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -103.29 -20.07 14.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.922 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 10.2 t -60.86 110.26 2.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.611 0.719 . . . . 0.0 110.872 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.4 Cg_endo -69.75 4.27 2.29 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.8 178.33 4.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.918 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 22.7 mmm -91.62 140.42 29.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -120.59 -76.17 0.58 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.49 -64.95 1.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.495 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 28.0 t0 -32.6 -48.01 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.82 0.343 . . . . 0.0 110.871 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.9 t80 -40.55 125.92 1.84 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.759 . . . . 0.0 110.886 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 155.74 65.05 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.637 2.225 . . . . 0.0 112.36 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.0 t -73.5 146.03 45.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.913 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 465' ' ' THR . 45.5 tttp -79.54 -69.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.3 mt -44.14 -59.56 2.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.432 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 58.3 t80 -39.56 -25.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.547 ' CE1' HD21 ' A' ' 482' ' ' LEU . 30.6 m170 -98.94 -50.83 4.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.823 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 464' ' ' HIS . 55.2 p -35.59 -43.24 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 32.5 p -125.96 -33.75 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.158 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.432 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 135.15 -38.12 1.84 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.514 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -108.56 166.24 10.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.2 t -126.25 131.77 51.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 470' ' ' ILE . 5.4 tp -80.66 21.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -99.57 -46.89 5.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 114.81 174.31 18.24 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.503 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.5 -17.38 13.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -101.56 43.49 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.83 146.18 44.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.6 ppp? -71.59 -22.05 61.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.854 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 16.9 m-85 -100.55 159.19 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.6 m -79.94 135.9 36.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -101.02 24.46 9.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -62.51 153.44 77.16 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.582 0.705 . . . . 0.0 110.876 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 119.94 6.81 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.693 2.262 . . . . 0.0 112.355 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.556 HD21 HD11 ' A' ' 490' ' ' LEU . 80.0 mt -41.18 143.73 0.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 10.7 p -138.65 162.0 35.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.105 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -39.46 -35.63 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -80.22 -68.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.853 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 489' ' ' LEU . 5.7 p -52.89 -55.13 25.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.154 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.29 -49.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -52.24 -39.18 59.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.465 ' CD2' ' CG ' ' A' ' 434' ' ' ARG . 65.1 mt -49.6 -65.89 0.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.556 HD11 HD21 ' A' ' 482' ' ' LEU . 72.7 mt -39.81 -61.12 0.88 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.917 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.91 -39.56 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.842 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -79.47 -40.89 28.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -62.21 -59.76 4.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.872 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 452' ' ' PRO . 41.2 mttt . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.81 0.338 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.412 ' HD3' ' O ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -97.76 33.78 2.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.893 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -115.84 149.18 39.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.894 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.515 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.7 tp -79.39 105.45 10.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 23.5 t -41.79 131.48 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -80.95 21.79 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.901 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -125.33 -42.2 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.905 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -64.01 -27.7 69.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 96.5 mt -44.72 -37.19 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.3 -27.76 13.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.177 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.62 -10.17 16.45 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -100.73 105.76 17.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.891 0.377 . . . . 0.0 110.884 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 40.4 t -138.45 122.26 17.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.869 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -46.18 -67.45 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.155 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -86.12 114.47 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.64 -79.17 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.155 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -81.74 12.79 3.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -116.55 1.73 12.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 12.9 t -80.18 110.99 18.54 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.621 0.724 . . . . 0.0 110.866 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.47 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.3 Cg_endo -69.77 7.08 1.08 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -99.25 -177.15 3.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 44.3 mmm -97.84 126.25 43.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.873 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -109.95 -74.89 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.51 -60.28 2.37 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.458 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 51.6 m-20 -34.48 -45.46 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.858 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.515 ' CD2' HD13 ' A' ' 436' ' ' LEU . 27.8 t80 -47.03 128.77 9.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.654 0.74 . . . . 0.0 110.879 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 150.79 68.92 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.323 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.405 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.6 t -75.72 150.07 37.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 465' ' ' THR . 9.3 ttmt -80.01 -68.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.5 mt -45.5 -57.54 4.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 64.5 t80 -40.71 -24.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.565 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.9 m-70 -99.9 -53.39 3.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 461' ' ' LYS . 43.6 p -34.7 -43.48 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.105 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 72.2 p -124.68 -35.23 2.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.13 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 136.46 -38.57 1.75 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.531 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -107.09 169.83 8.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 16.8 t -124.56 133.76 53.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.39 -38.84 82.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -50.28 -54.83 18.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 124.16 -159.35 18.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.449 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.77 -25.11 61.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.775 0.321 . . . . 0.0 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -99.95 47.21 0.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 33.9 t -78.1 149.41 33.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.6 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -80.66 18.54 0.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.6 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 20.2 m-85 -131.39 156.05 46.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.4 m -79.0 128.33 33.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.86 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -103.02 25.13 9.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.831 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.23 160.3 79.44 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.593 0.711 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 116.84 4.75 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.647 2.232 . . . . 0.0 112.359 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.565 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 37.8 mt -40.18 144.85 0.19 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 72.3 p -131.91 160.26 36.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -41.32 -32.67 0.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -78.27 -71.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.5 p -48.91 -51.15 31.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.126 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.47 -52.61 2.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.855 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -51.04 -49.7 60.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 94.2 mt -43.9 -65.18 0.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 35.9 mt -40.01 -57.32 1.66 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.7 -40.4 5.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.81 -52.43 9.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.3 tmm? -53.83 -64.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.933 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.796 0.332 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.543 ' HB3' HD23 ' A' ' 489' ' ' LEU . 8.2 mpt_? -92.63 41.67 1.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -122.12 152.68 39.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.52 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 13.4 tp -78.93 115.75 18.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 27.0 t -45.68 131.11 9.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -75.24 0.55 16.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -108.17 -50.11 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.434 ' CE2' ' HE1' ' A' ' 476' ' ' MET . 11.7 t80 -49.05 -30.05 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.8 mt -44.46 -33.75 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.086 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 60.2 p -103.91 -29.23 11.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.107 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.11 -10.11 22.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -98.6 99.38 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.86 104.81 5.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.44 -61.78 0.87 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.134 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -81.92 104.64 12.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.08 -74.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.087 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -81.42 2.7 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.899 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -104.51 -5.26 21.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.3 t -72.56 111.59 11.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.624 0.726 . . . . 0.0 110.864 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 2.02 3.88 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.688 2.259 . . . . 0.0 112.388 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -100.32 -174.64 2.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 29.1 mmm -98.19 142.34 29.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.877 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -121.23 -75.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.469 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.69 -66.28 1.65 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.43 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.469 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -33.0 -42.57 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.863 0.363 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.52 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.8 t80 -46.79 126.93 8.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.684 0.754 . . . . 0.0 110.861 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 144.94 55.45 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.255 . . . . 0.0 112.333 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 51.9 t -69.26 143.24 53.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.429 ' O ' HG23 ' A' ' 465' ' ' THR . 4.7 ttpm? -79.38 -65.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.89 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.5 mt -45.0 -57.84 3.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -40.51 -24.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.595 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 27.2 m170 -100.66 -52.49 3.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.458 ' C ' ' O ' ' A' ' 464' ' ' HIS . 58.3 p -32.24 -42.28 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.158 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 62.8 p -127.84 -36.92 1.97 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.15 -33.18 2.56 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.475 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -116.81 143.73 45.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.839 0.352 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.4 t -101.92 107.33 18.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.6 tp -40.49 -36.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.185 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -53.2 -61.87 2.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 107.45 -142.07 15.74 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.18 13.43 2.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.841 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -106.72 -25.22 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.895 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -43.14 125.87 3.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.605 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 0.8 OUTLIER -81.56 27.2 0.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.1 m-85 -125.29 158.1 34.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.6 m -80.12 137.68 36.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.831 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 38.0 m170 -108.59 17.98 21.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -60.31 153.43 58.78 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 117.13 4.9 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.709 2.273 . . . . 0.0 112.351 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 490' ' ' LEU . 23.7 mt -39.65 151.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 40.5 p -139.18 165.58 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.113 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' GLU . . . . . 0.43 ' HG3' ' CD ' ' A' ' 485' ' ' GLU . 9.9 pt-20 -40.27 -38.5 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.43 ' CD ' ' HG3' ' A' ' 484' ' ' GLU . 48.0 mp0 -80.43 -76.3 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.915 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.446 ' O ' ' N ' ' A' ' 489' ' ' LEU . 17.4 p -41.49 -50.92 3.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.124 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.474 ' HD3' HD13 ' A' ' 482' ' ' LEU . 12.0 tpt180 -39.41 -44.36 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.15 -40.08 80.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 434' ' ' ARG . 88.3 mt -46.68 -68.14 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 482' ' ' LEU . 92.8 mt -40.43 -57.55 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -42.54 -36.11 1.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -80.17 -38.47 31.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -68.88 -62.64 1.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.829 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.896 -179.956 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.777 0.323 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 57.48 42.08 25.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -138.32 154.29 48.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.624 HD13 ' CD2' ' A' ' 458' ' ' PHE . 32.8 tp -79.54 105.09 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.7 t -40.52 123.78 1.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -69.41 -3.16 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -105.28 -51.43 3.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.423 ' HB2' ' NE2' ' A' ' 455' ' ' HIS . 31.6 t80 -44.58 -37.64 3.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -41.03 -36.24 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.147 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 11.1 p -101.21 -35.23 9.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.99 -9.81 11.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.489 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 444' ' ' PHE . . . . . 0.462 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 5.5 t80 -95.31 83.25 3.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.904 0.383 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 22.1 t -118.42 113.93 22.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -43.95 -72.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.114 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 84.2 mtt85 -80.17 109.41 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.65 -73.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -76.06 -5.66 47.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -110.47 20.34 17.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 37.6 t -80.53 111.81 25.99 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.629 0.728 . . . . 0.0 110.909 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 1.43 4.46 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.691 2.261 . . . . 0.0 112.359 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -105.67 -176.08 2.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 454' ' ' MET . . . . . 0.484 ' CE ' ' HB2' ' A' ' 457' ' ' ASP . 29.1 mmm -100.78 140.58 34.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.924 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.423 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.4 m170 -119.9 -75.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -78.13 -67.3 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.484 ' HB2' ' CE ' ' A' ' 454' ' ' MET . 7.5 m-20 -32.99 -44.72 0.12 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.856 0.36 . . . . 0.0 110.884 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.624 ' CD2' HD13 ' A' ' 436' ' ' LEU . 15.2 t80 -45.28 126.24 5.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.633 0.73 . . . . 0.0 110.897 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 143.58 51.48 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.699 2.266 . . . . 0.0 112.341 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.432 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.1 t -70.69 145.03 50.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 19.9 ttpp -77.25 -64.99 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.8 mt -44.73 -59.44 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.446 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 87.5 t80 -39.62 -25.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 462' ' ' LEU . 42.9 m-70 -98.87 -53.61 3.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.885 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 464' ' ' HIS . 51.2 p -34.48 -34.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.126 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.0 p -133.59 -40.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.124 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.446 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 141.22 -38.57 1.52 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.46 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.43 152.1 30.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.1 t -102.26 141.73 34.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.446 HG22 HD13 ' A' ' 462' ' ' LEU . 8.3 tp -80.23 -26.08 11.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -50.92 -49.61 59.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 129.64 -167.17 21.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.478 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.49 -35.79 79.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.831 0.348 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -100.57 58.8 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.66 149.08 40.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.934 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -76.51 6.57 5.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 15.7 m-85 -125.78 154.74 42.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.844 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 23.3 m -80.37 141.44 35.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -110.25 26.98 10.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -64.97 153.76 88.02 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.624 0.726 . . . . 0.0 110.869 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 109.66 2.35 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.698 2.266 . . . . 0.0 112.39 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.447 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 47.4 mt -39.73 152.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' N ' ' A' ' 485' ' ' GLU . 72.5 p -137.46 158.51 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -38.95 -30.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.858 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.2 mm-40 -81.4 -74.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.42 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.1 p -46.24 -47.61 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.14 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.11 -47.04 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.86 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -56.99 -41.38 78.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 486' ' ' THR . 74.1 mt -47.66 -63.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 494' ' ' LEU . 72.1 mt -39.87 -60.03 1.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.929 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -40.26 -45.94 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.883 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 44.3 tttp -72.42 -49.11 35.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -48.23 -59.22 3.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 490' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.467 ' HD3' ' CE2' ' A' ' 453' ' ' TYR . 6.9 mtpt . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.752 0.31 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.472 ' CG ' HD21 ' A' ' 489' ' ' LEU . 0.1 OUTLIER 58.83 38.35 24.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.85 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.04 135.14 32.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.739 HD13 ' CD2' ' A' ' 458' ' ' PHE . 53.9 tp -60.61 117.42 5.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 28.3 t -58.86 126.4 27.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.841 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.32 29.03 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -134.61 -42.09 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.605 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 47.1 t80 -66.91 -21.86 65.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.905 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 61.7 mt -52.84 -32.8 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.143 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 61.1 p -108.26 11.29 27.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.57 -8.73 25.67 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -99.67 99.62 10.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.3 t -136.26 117.25 14.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.09 -67.59 0.27 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.081 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -85.72 114.41 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.21 -76.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.128 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -81.41 -2.57 49.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -105.59 11.99 31.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 20.1 t -80.81 111.32 22.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.631 0.729 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 0.77 5.2 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.675 2.25 . . . . 0.0 112.331 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.467 ' CE2' ' HD3' ' A' ' 433' ' ' LYS . 57.6 m-85 -100.3 -174.97 2.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.4 mmm -100.54 143.03 31.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.922 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 440' ' ' TYR . 13.6 m170 -122.04 -75.28 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.64 -69.44 1.4 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.466 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.491 ' C ' ' O ' ' A' ' 456' ' ' GLY . 20.3 t0 -31.05 -41.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.739 ' CD2' HD13 ' A' ' 436' ' ' LEU . 14.7 t80 -49.31 117.78 7.16 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.864 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 129.45 17.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.721 2.281 . . . . 0.0 112.311 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 138.17 13.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -73.99 -66.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 49.0 mt -45.02 -58.7 3.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' A' ' 467' ' ' GLY . 69.4 t80 -39.74 -24.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.498 ' O ' ' C ' ' A' ' 465' ' ' THR . 20.9 m80 -100.75 -53.19 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.826 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.4 p -29.64 -42.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.193 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 464' ' ' HIS . 65.9 p -126.66 -39.53 1.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 463' ' ' TYR . . . 146.72 -38.06 1.16 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.51 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 468' ' ' ASN . . . . . 0.411 ' C ' ' HA ' ' A' ' 463' ' ' TYR . 45.1 p-10 -113.83 168.93 9.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.855 0.359 . . . . 0.0 110.918 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.33 140.38 48.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.448 HG22 HD13 ' A' ' 462' ' ' LEU . 7.9 tp -76.98 -33.28 20.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.102 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -50.42 -65.46 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 145.87 -164.35 28.2 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.502 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.15 -22.63 59.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.822 0.344 . . . . 0.0 110.888 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -99.76 48.89 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -79.46 141.32 36.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.605 ' CE ' ' CE2' ' A' ' 440' ' ' TYR . 4.7 ppp? -81.11 25.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 24.1 m-85 -134.59 157.23 47.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.86 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.5 p -80.1 135.47 36.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -111.49 28.15 9.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.881 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.47 163.32 69.1 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.608 0.718 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 120.08 6.92 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.701 2.268 . . . . 0.0 112.318 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.523 HD21 HD11 ' A' ' 490' ' ' LEU . 30.3 mt -40.91 143.79 0.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 39.4 p -126.54 156.09 41.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -39.87 -34.1 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -76.74 -74.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.879 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 20.4 p -45.16 -50.44 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.465 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.03 -49.59 1.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -50.83 -45.31 59.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.472 HD21 ' CG ' ' A' ' 434' ' ' ARG . 93.8 mt -48.2 -64.1 0.89 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.523 HD11 HD21 ' A' ' 482' ' ' LEU . 97.1 mt -39.82 -53.75 2.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -46.13 -47.33 17.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.843 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -73.66 -57.74 3.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.86 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -46.4 -64.23 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.869 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 490' ' ' LEU . 10.5 mp . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.953 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.551 ' HE3' ' CE1' ' A' ' 453' ' ' TYR . 22.6 mtmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 38.14 50.33 1.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 435' ' ' GLU . . . . . 0.475 ' HB3' ' CD2' ' A' ' 453' ' ' TYR . 14.2 tt0 -138.07 145.05 41.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.918 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.411 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.6 tp -72.99 112.26 8.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.938 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 18.5 t -43.28 141.75 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.476 ' HG2' ' CD1' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -79.89 -5.64 55.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.91 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 439' ' ' PHE . . . . . 0.476 ' CD1' ' HG2' ' A' ' 438' ' ' LYS . 46.3 m-85 -110.17 -54.03 2.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -42.2 -23.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.9 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 441' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 439' ' ' PHE . 61.8 mt -50.53 -40.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.107 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 41.3 p -99.71 6.24 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.158 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 79.87 -9.61 44.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.464 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -99.85 100.88 11.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.369 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.3 t -131.41 122.96 27.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.5 -59.08 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.118 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 97.0 mtt180 -88.65 107.96 19.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.81 -77.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -82.59 25.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -132.87 0.85 3.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.928 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 6.9 t -78.89 111.73 21.96 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.66 0.743 . . . . 0.0 110.869 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 5.17 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.716 2.277 . . . . 0.0 112.291 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.551 ' CE1' ' HE3' ' A' ' 433' ' ' LYS . 20.7 m-85 -99.93 -176.27 3.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.967 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.2 mmm -95.43 134.61 38.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -117.19 -75.51 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.29 -62.15 2.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.477 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 10.0 m-20 -34.74 -50.69 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 0.0 110.823 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 436' ' ' LEU . 21.3 t80 -40.14 123.97 1.67 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 0.0 110.865 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 151.5 69.19 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.638 2.225 . . . . 0.0 112.322 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.543 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.8 t -73.95 145.96 44.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.404 ' O ' HG23 ' A' ' 465' ' ' THR . 29.6 tttt -78.76 -68.06 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.3 mt -44.25 -59.73 2.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.472 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 70.7 t80 -39.5 -25.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.924 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 30.2 m-70 -99.08 -52.93 3.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.429 ' C ' ' O ' ' A' ' 464' ' ' HIS . 53.1 p -34.75 -35.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.3 p -132.96 -37.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.472 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.34 -41.22 1.35 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.513 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.96 165.71 11.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.896 0.379 . . . . 0.0 110.87 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 47.5 t -117.9 150.16 39.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.9 tp -79.83 -34.85 15.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.154 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -53.54 -66.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 135.85 -171.08 22.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.445 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -35.02 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.818 0.342 . . . . 0.0 110.854 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -100.22 59.85 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 24.7 t -79.47 152.51 30.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.586 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 3.6 ppp? -68.73 -21.79 64.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.912 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.586 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.6 m-85 -105.51 159.41 15.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 27.3 m -79.12 140.38 37.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -104.24 24.34 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.16 154.6 60.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.6 0.714 . . . . 0.0 110.856 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 120.08 6.93 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.731 2.288 . . . . 0.0 112.347 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.517 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 41.1 mt -40.14 143.34 0.29 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 46.8 p -126.71 153.35 45.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.104 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 485' ' ' GLU . 4.3 pt-20 -40.26 -30.78 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.451 ' N ' ' HG3' ' A' ' 484' ' ' GLU . 11.5 tp10 -80.31 -73.64 0.35 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 60.2 p -45.0 -48.03 11.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.13 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.67 -42.27 1.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.832 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -61.31 -43.78 98.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.874 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 23.4 mt -45.03 -64.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.41 HD11 HD21 ' A' ' 482' ' ' LEU . 75.1 mt -39.87 -57.27 1.62 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.951 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.38 -43.58 1.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -79.0 -51.92 8.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.9 tmm? -53.69 -63.31 1.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 -179.994 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.766 0.317 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.02 54.19 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 435' ' ' GLU . . . . . 0.423 ' OE2' ' N ' ' A' ' 436' ' ' LEU . 0.8 OUTLIER -131.08 138.68 49.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.53 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 40.2 tp -57.91 114.42 2.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.8 t -47.72 138.42 8.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.92 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -77.02 -3.38 38.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -110.18 -51.06 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -43.15 -35.75 1.47 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.8 mt -39.89 -37.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 16.5 p -99.35 -36.01 9.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.162 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.08 11.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -97.19 88.88 4.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.875 0.369 . . . . 0.0 110.888 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 51.2 t -128.28 99.38 5.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.854 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -38.63 -61.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.108 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.448 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 61.9 mtt180 -77.31 105.18 8.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.58 -76.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 449' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 449' ' ' GLU . 32.2 tt0 -82.92 7.02 16.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -107.56 -12.03 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 18.4 t -68.63 111.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.587 0.708 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 4.47 2.19 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.672 2.248 . . . . 0.0 112.326 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -99.6 176.46 5.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.927 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 15.1 mmm -88.65 140.95 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.891 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -122.14 -74.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.505 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.39 -67.97 1.51 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.455 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.505 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.4 m-20 -29.94 -49.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.884 0.373 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.53 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.4 t80 -41.57 128.2 2.36 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.645 0.736 . . . . 0.0 110.884 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 150.01 67.59 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.67 2.247 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 52.8 t -72.23 142.29 48.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -76.83 -66.47 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 464' ' ' HIS . 33.0 mt -45.81 -57.76 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -42.48 -23.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.933 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.566 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 29.1 m-70 -99.02 -50.17 4.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.491 ' C ' ' O ' ' A' ' 464' ' ' HIS . 72.0 p -30.51 -47.84 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.118 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.9 p -127.23 -31.91 2.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.163 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.68 -34.05 2.46 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -110.46 145.33 37.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 0.0 110.902 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.0 t -106.36 118.64 37.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -50.26 -37.84 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -49.92 -50.45 46.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 106.4 -152.86 17.03 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.496 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -80.07 12.91 2.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 0.0 110.845 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -123.95 34.35 5.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 45.6 t -79.56 139.58 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.41 ' SD ' ' O ' ' A' ' 476' ' ' MET . 4.4 ppp? -81.1 22.46 0.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.401 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 16.0 m-85 -130.9 161.49 31.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.863 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.9 m -80.1 127.11 31.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.852 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -99.68 26.65 6.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.832 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' ASP . . . . . 0.41 ' HB2' ' HD2' ' A' ' 481' ' ' PRO . 3.1 p30 -69.68 154.86 94.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 481' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 480' ' ' ASP . 53.5 Cg_endo -69.76 120.55 7.32 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.714 2.276 . . . . 0.0 112.372 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.566 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 54.4 mt -39.79 132.06 1.76 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.423 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 69.4 p -109.45 172.24 6.97 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -49.7 -35.68 22.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' A' ' 486' ' ' THR . 9.4 tp10 -78.54 -75.33 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 485' ' ' GLU . 49.6 p -36.37 -52.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.134 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.6 OUTLIER -39.99 -47.12 2.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.09 -44.35 95.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 486' ' ' THR . 78.1 mt -48.85 -65.68 0.53 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 45.2 mt -40.08 -55.27 2.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -42.81 -41.67 3.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 492' ' ' LYS . 7.2 tmtm? -76.9 -53.26 8.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -50.87 -58.96 4.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.847 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.87 -179.924 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 63.1 mttt . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.744 0.307 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -79.05 48.31 0.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.862 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -121.64 152.39 39.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 40.5 tp -67.52 124.0 22.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.935 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 17.1 t -57.26 127.6 32.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.04 -3.38 16.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -107.62 -44.06 4.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.45 ' CD2' ' CG ' ' A' ' 455' ' ' HIS . 30.4 t80 -51.65 -38.57 55.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.902 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.7 mt -39.58 -35.38 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.119 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.97 -31.27 11.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.133 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 112.89 -4.22 25.79 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.479 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 444' ' ' PHE . . . . . 0.451 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -100.33 85.91 3.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.875 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 48.6 t -121.27 102.54 8.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.867 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.14 -69.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.8 mtt85 -76.9 104.65 7.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.909 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.94 -74.55 0.32 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -81.93 21.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.944 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -128.82 -4.28 5.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 32.8 t -70.66 111.74 10.68 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.632 0.729 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 2.39 3.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 44.4 m-85 -100.99 177.14 5.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 37.8 mmm -90.97 142.54 27.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.45 ' CG ' ' CD2' ' A' ' 440' ' ' TYR . 18.5 m170 -120.36 -75.77 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.46 -64.84 1.79 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.457 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -32.29 -47.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 21.6 t80 -46.16 122.59 6.43 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.727 . . . . 0.0 110.864 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 143.86 51.8 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.325 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.6 t -65.7 135.56 55.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 465' ' ' THR . 6.5 ttpt -73.44 -64.96 0.88 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 464' ' ' HIS . 44.3 mt -44.44 -58.31 3.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.401 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 28.0 t80 -39.11 -25.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' A' ' 462' ' ' LEU . 64.3 m-70 -100.67 -55.33 2.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.822 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 461' ' ' LYS . 30.2 p -32.98 -39.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.2 p -128.58 -38.29 1.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.401 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 138.27 -38.26 1.71 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.523 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -111.01 155.42 22.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.856 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 23.9 t -106.52 136.09 46.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.404 HG22 HD13 ' A' ' 462' ' ' LEU . 6.1 tp -76.07 -25.97 17.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -56.33 -39.38 72.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 109.75 -161.11 13.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.516 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.8 -13.75 59.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.832 0.349 . . . . 0.0 110.935 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -99.98 29.62 4.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -71.96 131.37 42.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.491 ' C ' ' SD ' ' A' ' 476' ' ' MET . 0.0 OUTLIER -81.25 34.04 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.449 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 10.7 m-85 -132.92 155.12 49.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.922 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.7 m -80.18 127.91 32.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -99.76 15.67 26.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.31 156.23 61.92 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.597 0.713 . . . . 0.0 110.864 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 119.71 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.615 2.21 . . . . 0.0 112.35 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.525 HD11 ' CD1' ' A' ' 490' ' ' LEU . 29.0 mt -39.87 147.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 82.1 p -126.27 157.86 37.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.095 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -41.91 -33.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -80.96 -76.4 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 489' ' ' LEU . 59.6 p -44.92 -48.99 11.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.165 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -38.86 -45.16 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -56.22 -41.31 75.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 486' ' ' THR . 51.9 mt -45.88 -62.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.525 ' CD1' HD11 ' A' ' 482' ' ' LEU . 81.8 mt -41.74 -56.55 2.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.958 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -42.72 -41.99 3.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -80.2 -60.01 2.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' MET . . . . . 0.511 ' CE ' HD12 ' A' ' 494' ' ' LEU . 13.4 tmm? -41.6 -57.4 2.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.895 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 494' ' ' LEU . . . . . 0.511 HD12 ' CE ' ' A' ' 493' ' ' MET . 10.4 mp . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 18.5 mttp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.753 0.311 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -118.88 44.77 2.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -120.16 154.48 34.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.897 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 35.6 tp -70.86 129.02 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.4 t -66.0 131.63 46.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.919 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.42 2.53 9.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.933 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -114.95 -47.46 2.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -48.17 -35.2 11.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.9 mt -41.12 -33.85 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.168 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 66.6 p -99.74 -33.33 10.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.09 -9.08 13.95 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.15 98.57 9.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.378 . . . . 0.0 110.834 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.6 t -134.5 111.56 10.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.04 -62.08 0.78 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 45.6 mtt180 -85.28 111.07 19.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.93 -79.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.086 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.06 0.99 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -102.17 -5.07 24.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 9.7 t -70.38 111.92 11.07 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.59 0.71 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.659 2.239 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.524 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -100.29 -176.17 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.93 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 21.2 mmm -97.36 138.75 34.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.5 m170 -119.82 -75.39 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.43 -62.26 2.09 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.455 ' C ' ' O ' ' A' ' 456' ' ' GLY . 68.9 m-20 -34.18 -50.92 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 110.875 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -40.84 127.96 1.94 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.679 0.752 . . . . 0.0 110.886 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 140.42 42.69 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.681 2.254 . . . . 0.0 112.354 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 13.7 t -59.13 144.28 46.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.902 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 56.1 tttp -77.97 -68.84 0.59 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.86 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.579 HD13 HG22 ' A' ' 470' ' ' ILE . 29.8 mt -45.15 -58.09 3.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.448 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 54.9 t80 -40.25 -24.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.897 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.55 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.5 m-70 -100.17 -52.42 3.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.433 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.6 p -33.44 -41.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.149 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 38.1 p -128.37 -29.22 2.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.448 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 128.75 -38.74 1.99 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.439 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -109.83 149.08 30.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.851 0.358 . . . . 0.0 110.885 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.1 t -102.22 131.43 48.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.898 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.579 HG22 HD13 ' A' ' 462' ' ' LEU . 8.5 tp -77.73 -21.94 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.143 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -50.63 -48.25 58.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 132.14 -168.97 22.33 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.508 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.94 -33.81 72.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.842 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.02 64.06 0.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.0 t -73.58 153.35 40.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.895 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.535 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.9 ppp? -75.61 -20.03 58.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.535 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 18.0 m-85 -104.26 161.17 14.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.867 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 68.5 m -79.97 151.27 30.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 48.6 m170 -115.04 30.2 7.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.91 157.86 85.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.586 0.708 . . . . 0.0 110.906 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 131.27 20.8 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.713 2.275 . . . . 0.0 112.306 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.55 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 38.6 mt -56.15 149.38 16.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 485' ' ' GLU . 66.4 p -136.35 154.97 50.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.132 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.79 -29.7 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.4 mt-10 -78.94 -74.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.913 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.3 p -48.6 -50.64 31.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.108 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -48.53 2.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.852 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -52.52 -40.77 62.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 77.2 mt -53.26 -61.25 2.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.872 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 94.9 mt -41.87 -56.65 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -41.95 -40.61 2.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.871 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.09 -57.18 3.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.894 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.7 tmm? -48.96 -60.56 2.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 96.6 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 11.3 mttp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.715 0.293 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.583 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.7 mpt_? -121.59 42.98 2.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -116.58 151.4 36.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 37.3 tp -58.73 125.99 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.874 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 14.7 t -65.06 146.25 55.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -79.91 -10.64 59.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.88 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -104.1 -46.14 4.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 455' ' ' HIS . 21.9 t80 -47.43 -36.33 9.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.889 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.1 mt -42.95 -37.68 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.114 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 70.8 p -101.6 -36.69 8.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.138 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.46 -4.76 17.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 444' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 10.6 t80 -99.63 71.33 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 110.853 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.77 105.31 15.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -61.27 0.88 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.104 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -83.44 109.48 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.871 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.74 -78.58 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.125 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -81.34 -1.21 44.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -99.4 0.07 41.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 10.3 t -80.08 111.11 19.31 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.627 0.727 . . . . 0.0 110.885 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.7 Cg_endo -69.8 3.83 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.7 2.267 . . . . 0.0 112.336 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -99.87 179.99 4.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.0 mmm -95.16 140.54 29.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.823 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 440' ' ' TYR . 18.8 m170 -119.19 -76.11 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.37 -65.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.464 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.451 ' C ' ' O ' ' A' ' 456' ' ' GLY . 29.0 m-20 -33.93 -43.69 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.862 0.363 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 18.6 t80 -43.19 128.48 3.46 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.598 0.713 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 149.25 66.7 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.645 2.23 . . . . 0.0 112.399 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.467 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 9.2 t -74.28 150.3 40.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.89 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 465' ' ' THR . 16.3 ttmt -80.75 -69.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.1 mt -43.77 -60.3 1.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 463' ' ' TYR . . . . . 0.412 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 86.3 t80 -39.29 -25.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 13.6 m-70 -99.48 -51.67 3.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 464' ' ' HIS . 54.2 p -33.78 -38.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.0 p -131.29 -36.71 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.156 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' GLY . . . . . 0.412 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 140.3 -39.07 1.52 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.483 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 468' ' ' ASN . . . . . 0.438 ' CG ' ' N ' ' A' ' 469' ' ' CYS . 21.2 t-20 -107.79 168.18 9.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 469' ' ' CYS . . . . . 0.438 ' N ' ' CG ' ' A' ' 468' ' ' ASN . 17.7 t -120.9 150.3 41.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.3 tp -76.02 -36.49 31.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.112 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -52.6 -61.79 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 138.61 -156.64 24.26 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.99 -39.63 87.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.755 0.312 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.67 63.71 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -79.06 144.47 34.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.89 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 3.9 ppp? -55.71 -24.2 33.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.875 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 33.5 m-85 -104.28 160.14 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.884 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.4 m -80.04 145.87 32.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.898 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -111.55 22.58 14.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 480' ' ' ASP . . . . . 0.407 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 71.1 m-20 -58.41 156.35 22.81 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.627 0.727 . . . . 0.0 110.83 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 481' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.4 Cg_endo -69.74 112.1 2.99 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.716 2.278 . . . . 0.0 112.358 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 18.2 mt -39.72 129.37 2.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.93 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 7.2 p -102.63 -179.94 4.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.11 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 484' ' ' GLU . . . . . 0.431 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 0.2 OUTLIER -70.41 -30.83 67.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.431 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 12.7 pt-20 -79.0 -42.33 26.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.917 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.9 p -68.57 -50.85 48.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.132 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.0 OUTLIER -39.38 -31.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.12 -41.38 74.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 434' ' ' ARG . 49.9 mt -53.56 -66.06 0.46 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 91.8 mt -39.93 -56.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -39.69 -41.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -80.09 -42.76 22.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -59.6 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 452' ' ' PRO . 56.2 mttt . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.728 0.299 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.668 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.8 tpp85 -89.15 63.75 6.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -139.17 144.08 38.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.854 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 35.6 tp -61.95 132.5 53.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 437' ' ' CYS . . . . . 0.446 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 7.0 t -67.06 137.79 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -77.48 -7.28 55.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.91 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -109.54 -44.12 3.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.46 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 39.2 t80 -48.13 -34.66 10.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.905 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 63.5 mt -43.48 -32.9 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.129 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 p -99.51 -33.8 10.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.139 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.01 -10.58 13.58 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.501 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -100.43 98.99 9.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.865 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 37.6 t -136.42 109.47 7.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.51 -59.31 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 7.8 mtm105 -80.49 107.16 13.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.18 -77.61 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -82.43 -10.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -99.45 15.61 25.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.891 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 35.8 t -80.42 111.72 25.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.1 Cg_endo -69.75 3.21 2.9 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.64 2.227 . . . . 0.0 112.368 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -105.35 -175.11 2.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 40.3 mmm -100.74 136.52 40.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.899 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.46 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 24.8 m170 -118.13 -75.24 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.74 -65.3 1.78 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.516 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 456' ' ' GLY . 8.3 m-20 -33.44 -47.26 0.21 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.826 0.346 . . . . 0.0 110.847 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 17.2 t80 -43.46 130.3 3.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.64 0.734 . . . . 0.0 110.845 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 146.25 59.34 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.685 2.257 . . . . 0.0 112.345 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.533 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 45.4 t -70.19 146.14 50.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.885 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -79.64 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 464' ' ' HIS . 35.2 mt -45.41 -59.77 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.958 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -40.91 -22.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 28.5 m-70 -100.19 -54.96 2.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.47 ' C ' ' O ' ' A' ' 464' ' ' HIS . 71.8 p -31.17 -41.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.136 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.408 ' N ' ' O ' ' A' ' 464' ' ' HIS . 77.8 p -128.75 -36.78 1.8 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.114 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 137.9 -38.07 1.75 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.476 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -106.72 174.32 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.866 0.365 . . . . 0.0 110.852 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.8 t -133.17 128.7 36.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.4 tp -72.11 -26.63 25.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -49.59 -43.52 46.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.15 -169.59 23.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.6 -29.48 51.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.773 0.321 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -100.67 44.33 1.02 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 47.7 t -51.17 144.27 9.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.513 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 5.1 ppp? -65.42 -17.35 64.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.513 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 17.8 m-85 -102.81 159.44 15.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 29.1 m -80.13 132.41 35.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -100.8 23.5 10.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.77 159.51 52.94 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.612 0.72 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 110.79 2.65 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.671 2.247 . . . . 0.0 112.332 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.48 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 24.9 mt -40.16 131.5 2.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 483' ' ' THR . . . . . 0.564 ' OG1' HG23 ' A' ' 486' ' ' THR . 24.8 p -99.59 169.63 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.14 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -56.2 -30.98 63.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -81.41 -55.47 4.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.575 ' HA ' HD12 ' A' ' 489' ' ' LEU . 47.6 p -55.32 -37.95 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.119 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 487' ' ' ARG . 0.0 OUTLIER -52.3 -41.84 63.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -65.28 -33.39 75.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.668 HD22 ' O ' ' A' ' 434' ' ' ARG . 62.9 mt -59.39 -65.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 493' ' ' MET . 40.6 mt -40.13 -61.57 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -39.95 -41.91 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -79.94 -31.02 40.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' MET . . . . . 0.467 ' N ' ' O ' ' A' ' 490' ' ' LEU . 14.0 tmm? -63.32 -59.4 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.886 -179.964 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.778 0.323 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 434' ' ' ARG . . . . . 0.476 ' HB2' ' CD2' ' A' ' 489' ' ' LEU . 0.0 OUTLIER -83.08 35.12 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -115.37 154.59 28.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 436' ' ' LEU . . . . . 0.502 HD13 ' CD2' ' A' ' 458' ' ' PHE . 52.4 tp -65.04 117.78 8.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.921 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 437' ' ' CYS . . . . . 0.468 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.1 t -50.66 116.99 2.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -60.23 -11.51 6.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -100.54 -48.68 4.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.49 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 42.3 t80 -47.09 -36.55 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 64.6 mt -40.05 -35.31 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.157 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 20.2 p -100.4 -33.45 10.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.56 -8.68 15.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.508 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.01 94.1 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 4.5 t -132.68 106.91 8.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.21 -67.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 25.0 mtm-85 -67.07 101.62 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.51 -75.11 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.072 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -81.34 -6.62 59.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -112.6 23.54 13.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.0 t -73.95 114.77 35.93 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.609 0.719 . . . . 0.0 110.925 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -5.92 17.36 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.68 2.254 . . . . 0.0 112.358 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -106.59 -173.54 2.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.1 mmm -99.63 148.55 24.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.916 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 455' ' ' HIS . . . . . 0.49 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 23.9 m170 -126.3 -76.68 0.58 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.837 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' N ' ' A' ' 458' ' ' PHE . . . -80.91 -65.28 1.72 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.475 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.2 m-20 -33.98 -35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 458' ' ' PHE . . . . . 0.502 ' CD2' HD13 ' A' ' 436' ' ' LEU . 16.3 t80 -56.79 124.9 66.57 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.665 0.745 . . . . 0.0 110.836 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 135.08 29.66 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 2.271 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 7.4 t -57.68 147.74 26.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.837 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -80.27 -68.16 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 464' ' ' HIS . 25.6 mt -45.52 -58.19 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.929 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -41.22 -23.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.557 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.4 m-70 -99.91 -51.41 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 80.8 p -33.11 -48.14 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 50.5 p -123.36 -32.32 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.167 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.22 -38.57 1.84 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.479 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -105.58 156.96 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.889 0.376 . . . . 0.0 110.873 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 11.4 t -117.3 130.82 56.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.872 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.8 tp -57.21 -29.3 31.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.143 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -56.75 -63.53 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.23 -148.26 19.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.501 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -76.31 -38.44 56.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.803 0.335 . . . . 0.0 110.827 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -100.4 63.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 51.9 t -78.86 147.61 33.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.4 ppp? -59.43 -23.59 62.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 25.0 m-85 -103.53 161.29 14.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 59.2 m -80.24 141.07 35.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.833 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -108.89 29.34 7.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.34 152.86 93.78 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.642 0.734 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.81 116.37 4.53 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 0.0 112.33 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.557 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 40.2 mt -40.06 147.54 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.2 p -129.74 155.46 45.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.11 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 3.5 pm0 -39.38 -31.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 485' ' ' GLU . . . . . 0.401 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 6.0 tm-20 -80.36 -73.99 0.33 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.689 ' HA ' HD12 ' A' ' 489' ' ' LEU . 15.7 p -47.61 -49.61 26.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.151 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -43.5 1.39 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -59.71 -41.82 91.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 486' ' ' THR . 31.5 mt -51.08 -64.79 0.7 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 490' ' ' LEU . . . . . 0.515 ' CD1' HD21 ' A' ' 482' ' ' LEU . 44.6 mt -40.62 -59.45 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -39.08 -37.31 0.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -38.91 30.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.925 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 493' ' ' MET . . . . . 0.437 ' N ' ' O ' ' A' ' 490' ' ' LEU . 12.1 tmm? -62.8 -58.75 6.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.825 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.92 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 433' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 17.0 mttm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.786 0.327 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 38.5 mmm-85 -109.17 39.49 2.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -112.25 151.09 30.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.77 124.12 20.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 37.8 t -67.75 139.47 56.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.455 ' HA ' HD12 ' A' ' 441' ' ' ILE . 2.7 mtmp? -79.57 4.75 14.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -109.12 -53.61 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.878 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 440' ' ' TYR . . . . . 0.463 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 22.1 t80 -46.89 -39.99 13.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 441' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 438' ' ' LYS . 53.4 mt -40.54 -37.98 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.097 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.7 p -101.7 -35.94 8.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.156 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.02 -9.96 13.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -99.06 87.62 3.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.892 0.377 . . . . 0.0 110.886 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.4 t -125.01 103.6 8.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.71 -59.08 1.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.174 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.7 mtt180 -81.98 107.52 14.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -79.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -82.6 8.5 11.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -108.34 -12.67 15.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 14.6 t -65.77 111.26 5.92 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.615 0.722 . . . . 0.0 110.893 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 452' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.6 Cg_endo -69.79 2.99 3.05 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.64 2.227 . . . . 0.0 112.342 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 453' ' ' TYR . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 80.3 m-85 -100.1 176.1 5.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 32.1 mmm -91.86 140.66 29.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.866 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -117.81 -77.25 0.57 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.464 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.84 -66.98 1.58 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' A' ' 456' ' ' GLY . 25.2 m-20 -32.58 -43.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.52 130.31 6.33 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.626 0.727 . . . . 0.0 110.85 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 144.3 53.79 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 0.0 112.322 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' CYS . . . . . 0.492 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 20.1 t -65.71 141.95 58.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 461' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 465' ' ' THR . 72.3 tttt -75.91 -66.74 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 462' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.0 mt -44.67 -58.64 2.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -39.37 -25.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' HIS . . . . . 0.54 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 48.2 m-70 -100.58 -53.14 3.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 465' ' ' THR . . . . . 0.474 ' C ' ' O ' ' A' ' 464' ' ' HIS . 56.0 p -31.38 -42.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.149 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 46.5 p -129.49 -32.92 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.149 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.95 -41.35 1.5 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.49 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -103.72 150.47 24.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.922 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 469' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 471' ' ' ASN . 53.3 t -110.69 99.9 8.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.87 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' ILE . . . . . 0.66 HG23 ' O ' ' A' ' 470' ' ' ILE . 8.1 tp -80.51 38.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 471' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 469' ' ' CYS . 30.2 m-20 -95.76 -54.73 3.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 170.11 154.32 9.3 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -47.42 -47.54 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.819 0.342 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -100.92 55.53 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -42.06 152.51 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 476' ' ' MET . . . . . 0.473 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 4.2 ppp? -77.31 -18.39 57.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.855 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.473 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.7 m-85 -105.72 158.93 16.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.862 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 67.5 m -80.1 144.81 32.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.852 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -108.12 31.87 5.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.75 158.07 81.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.602 0.715 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 134.49 28.12 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.688 2.259 . . . . 0.0 112.377 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.54 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 44.7 mt -62.13 137.03 58.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 69.1 p -119.9 152.55 37.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.125 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -40.03 -29.23 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.71 -75.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.838 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.45 ' O ' ' N ' ' A' ' 489' ' ' LEU . 48.6 p -46.9 -47.96 21.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.116 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 487' ' ' ARG . . . . . 0.412 ' HD3' HD13 ' A' ' 482' ' ' LEU . 4.4 tpt180 -40.34 -41.09 1.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -64.18 -39.27 93.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.946 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 486' ' ' THR . 79.1 mt -48.08 -67.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.87 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 60.7 mt -41.26 -57.18 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -39.96 -42.44 1.36 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.88 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -79.79 -44.61 20.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.882 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.4 tmm? -54.89 -59.29 4.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.869 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 -179.934 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 32.6 p -125.47 -44.56 1.84 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.888 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 51.3 p -66.22 -62.39 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.86 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 80.55 -46.09 3.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.515 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 18.1 t -58.93 156.27 11.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.359 . . . . 0.0 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' SER . . . . . 0.404 ' O ' ' C ' ' A' ' 428' ' ' GLY . 52.9 p -146.49 111.28 5.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.822 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 428' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 427' ' ' SER . . . -36.23 141.12 0.21 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.499 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -79.26 106.41 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 3.6 mp -138.77 160.08 64.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.638 0.732 . . . . 0.0 110.913 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 80.38 0.9 Allowed 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.655 2.236 . . . . 0.0 112.306 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 30.6 mmtm -146.66 125.01 12.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 18.4 mmtp -84.6 120.18 26.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.403 ' O ' HD22 ' A' ' 489' ' ' LEU . 0.0 OUTLIER -100.15 43.01 1.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.86 -180.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 435' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 436' ' ' LEU . 51.3 tp10 -114.52 162.54 16.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.916 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.454 ' N ' ' HG3' ' A' ' 435' ' ' GLU . 26.4 tp -74.65 104.72 5.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 34.9 t -42.41 135.3 2.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.477 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -71.1 -5.6 32.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.925 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -105.48 -49.4 3.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.555 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 40.6 t80 -43.27 -35.42 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -44.11 -39.1 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 58.6 p -100.32 -37.78 8.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.04 -4.52 18.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' PHE . . . . . 0.476 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 9.2 t80 -99.54 77.65 2.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.23 107.37 15.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.888 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.41 -59.0 1.41 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.102 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -84.77 111.12 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.14 -76.85 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.062 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -81.56 -5.21 57.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -99.4 6.83 45.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.869 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 44.8 t -80.09 111.41 21.79 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 1.5 4.34 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.692 2.261 . . . . 0.0 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -102.05 179.6 4.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 18.9 mmm -95.48 143.32 26.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.93 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.555 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 21.9 m170 -120.51 -77.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.18 -63.2 1.9 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.52 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.8 m-20 -34.0 -46.65 0.24 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.789 0.328 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -43.17 129.36 3.42 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.591 0.71 . . . . 0.0 110.907 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 146.03 59.04 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.3 t -69.01 145.28 53.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.88 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.406 ' O ' HG23 ' A' ' 465' ' ' THR . 29.4 tttp -80.09 -65.6 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.1 mt -44.73 -58.64 2.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -39.61 -25.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.49 ' N ' ' O ' ' A' ' 462' ' ' LEU . 27.9 m170 -100.29 -52.46 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.855 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 464' ' ' HIS . 70.7 p -31.61 -45.31 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.15 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 76.7 p -126.01 -34.66 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.89 -37.69 1.98 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.499 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -108.58 140.73 41.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 110.866 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.3 t -100.55 135.18 42.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 471' ' ' ASN . 5.6 tp -61.2 -42.03 91.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.156 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 471' ' ' ASN . . . . . 0.438 ' N ' HG23 ' A' ' 470' ' ' ILE . 31.6 m-20 -51.84 -57.48 9.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 116.12 -149.0 18.88 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -75.76 -16.03 60.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 110.866 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.18 44.41 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.832 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 t -79.48 147.96 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.572 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.3 ppp? -76.14 -11.15 59.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.572 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.3 m-85 -107.96 160.19 15.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 74.8 m -77.77 143.48 37.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -114.73 31.79 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.841 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -72.87 159.43 85.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.606 0.717 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 120.86 7.58 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.687 2.258 . . . . 0.0 112.37 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 27.1 mt -42.99 148.51 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.7 p -131.11 154.77 47.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.156 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -39.95 -31.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -80.01 -74.13 0.32 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 70.1 p -42.83 -46.33 5.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.18 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.16 -46.5 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -55.9 -38.33 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.837 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 434' ' ' ARG . 34.7 mt -53.03 -65.86 0.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.921 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 84.3 mt -40.64 -56.6 2.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -39.95 -43.36 1.51 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.15 -59.94 2.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -41.41 -59.4 1.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.868 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.81 -62.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -40.47 -45.07 2.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -62.27 -58.52 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.87 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.47 -64.81 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.861 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -39.41 -62.81 0.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -52.04 -54.03 34.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -87.59 89.45 8.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -112.47 141.0 16.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.436 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -112.51 146.46 38.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.741 0.305 . . . . 0.0 111.118 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -77.31 143.62 38.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.883 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -143.53 127.25 17.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.839 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -49.04 160.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -165.94 154.08 10.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -167.9 174.63 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.897 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 96.3 t -104.28 102.5 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.131 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -49.6 145.22 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -73.27 131.04 41.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.31 -43.88 69.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -169.33 107.58 0.41 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -82.52 147.01 28.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.924 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 86.6 p -54.58 143.73 23.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.847 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -130.37 152.93 19.94 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.482 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -173.46 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.688 2.258 . . . . 0.0 112.351 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.2 t -116.83 160.66 20.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.68 133.26 30.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 119.072 -0.849 . . . . 0.0 112.523 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 422' ' ' GLY . . . . . 0.436 ' O ' ' C ' ' A' ' 423' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 423' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 422' ' ' GLY . 28.4 t -34.88 136.89 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.857 0.361 . . . . 0.0 110.825 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 2.7 t -108.31 150.6 27.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -83.34 -170.81 46.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.506 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 14.5 m -150.65 122.92 8.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.877 0.37 . . . . 0.0 110.799 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 1.9 t -98.78 -38.32 9.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' GLY . . . . . 0.421 ' O ' HD12 ' A' ' 430' ' ' LEU . . . 42.53 -111.75 0.38 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.507 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -49.33 146.06 4.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.9 0.381 . . . . 0.0 110.876 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.421 HD12 ' O ' ' A' ' 428' ' ' GLY . 5.0 mp -114.14 144.46 31.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.562 0.696 . . . . 0.0 110.939 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.77 -91.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.707 2.272 . . . . 0.0 112.368 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -103.97 163.25 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.464 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 24.2 mttm -72.22 163.09 28.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.916 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.526 ' HB3' HD23 ' A' ' 489' ' ' LEU . 0.2 OUTLIER -120.53 48.34 1.62 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -139.47 154.66 47.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.524 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 14.5 tp -70.16 143.26 52.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 22.6 t -74.11 146.69 43.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.892 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.484 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.2 OUTLIER -77.35 -12.5 59.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.912 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -104.49 -48.36 3.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.504 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 37.7 t80 -42.94 -36.38 1.52 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.941 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 441' ' ' ILE . . . . . 0.474 HG12 HD21 ' A' ' 436' ' ' LEU . 79.2 mt -40.1 -36.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.76 -34.68 10.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.96 -9.03 21.25 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -98.86 81.93 2.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.821 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.1 t -118.26 100.32 7.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.06 -59.61 1.43 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.103 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -74.46 96.19 2.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.18 -76.34 0.23 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.145 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.56 20.3 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' ASN . . . . . 0.533 ' O ' ' ND2' ' A' ' 450' ' ' ASN . 0.2 OUTLIER -124.98 -1.32 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.2 t -80.16 111.24 20.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.644 0.735 . . . . 0.0 110.925 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 0.26 5.88 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.664 2.243 . . . . 0.0 112.348 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.464 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 78.5 m-85 -100.01 175.69 5.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 48.8 mmm -90.09 143.34 26.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.898 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.504 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 22.2 m170 -120.03 -75.85 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.28 -68.15 1.5 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.467 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.452 ' C ' ' O ' ' A' ' 456' ' ' GLY . 5.9 m-20 -34.5 -35.53 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.844 0.354 . . . . 0.0 110.862 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 20.7 t80 -51.81 124.05 26.45 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.663 0.744 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 140.99 43.87 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.721 2.281 . . . . 0.0 112.291 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.36 142.12 55.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.415 ' O ' HG23 ' A' ' 465' ' ' THR . 78.6 tttt -76.81 -65.59 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.885 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.9 mt -44.99 -58.25 3.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -40.72 -23.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.564 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.9 m-70 -100.37 -51.49 3.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.878 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.464 ' C ' ' O ' ' A' ' 464' ' ' HIS . 49.0 p -31.37 -40.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 464' ' ' HIS . 75.6 p -132.93 -32.75 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.53 -34.81 2.3 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -110.0 149.21 30.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 15.0 t -104.24 151.43 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.1 tp -79.33 -37.13 18.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.112 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -49.89 -65.94 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 139.67 -169.39 24.64 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.527 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.19 -24.54 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.35 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -104.9 46.92 0.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.75 147.62 47.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.528 ' SD ' ' CE1' ' A' ' 477' ' ' PHE . 5.2 ppp? -79.67 11.74 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.851 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.528 ' CE1' ' SD ' ' A' ' 476' ' ' MET . 14.0 m-85 -123.07 155.71 36.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 8.0 m -75.36 127.09 32.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -103.03 16.12 27.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.03 156.44 74.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.647 0.737 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 121.26 7.94 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.687 2.258 . . . . 0.0 112.342 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.564 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 59.3 mt -41.49 144.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.921 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 485' ' ' GLU . 4.4 p -138.11 158.12 44.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.162 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -38.69 -29.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 483' ' ' THR . 32.4 mt-10 -81.24 -75.77 0.27 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 489' ' ' LEU . 68.1 p -50.03 -47.52 53.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.139 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.09 -36.5 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -65.21 -41.61 94.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 434' ' ' ARG . 87.8 mt -46.9 -62.61 1.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 66.4 mt -40.32 -57.12 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -42.54 -38.24 1.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.853 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.98 -52.37 8.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.5 -60.83 2.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 8.0 mp -49.84 -47.43 51.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.932 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.05 -45.08 31.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.128 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.63 -47.58 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 498' ' ' ALA . 26.3 t0 -73.04 -68.09 0.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -37.56 -41.77 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.087 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -52.26 -60.7 2.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.892 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -42.79 -48.72 5.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 123.58 121.85 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.482 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -139.24 117.53 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.763 0.316 . . . . 0.0 111.115 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -104.58 86.76 2.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.813 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -127.94 92.6 3.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -108.84 147.36 32.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -109.27 174.55 5.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -122.15 144.66 48.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.895 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 99.8 t -99.2 114.97 38.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.19 112.91 24.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.889 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.16 147.56 16.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 512' ' ' LYS . 14.9 mt -97.72 78.26 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.941 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 511' ' ' LEU . 63.7 mttt 34.95 41.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.883 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.25 147.36 0.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 2.4 m -172.71 159.21 4.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -116.88 64.04 0.36 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.504 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 173.23 11.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.69 2.26 . . . . 0.0 112.376 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.5 m -169.32 128.62 1.02 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 19.1 m -131.43 163.51 27.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.85 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.477 -179.984 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 18.8 m -39.57 117.65 0.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.896 0.379 . . . . 0.0 110.825 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 29.8 p -150.31 166.1 31.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.823 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 139.19 96.45 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.486 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 43.6 t -58.68 154.83 13.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.901 0.381 . . . . 0.0 110.811 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 19.7 m -156.88 146.96 21.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -165.51 129.06 1.88 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -87.86 145.62 25.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 0.0 110.914 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 9.0 mt -137.21 151.46 71.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 0.0 110.898 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -2.43 10.17 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.653 2.235 . . . . 0.0 112.304 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -111.09 158.24 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.882 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -131.09 131.48 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.45 ' HB3' HD22 ' A' ' 489' ' ' LEU . 7.6 mpt_? -105.53 44.67 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -113.71 152.17 30.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.897 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 37.4 tp -63.12 114.63 3.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.976 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.71 131.99 52.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.91 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 15.47 1.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.41 -37.11 3.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.438 ' CZ ' ' HE2' ' A' ' 476' ' ' MET . 34.9 t80 -68.09 -35.9 78.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.88 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.0 mt -43.19 -33.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.5 p -102.08 -36.47 8.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 120.09 -10.15 11.05 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 444' ' ' PHE . . . . . 0.418 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 8.2 t80 -99.65 85.86 3.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.871 0.367 . . . . 0.0 110.913 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.1 t -121.16 110.49 16.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.56 -70.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.095 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -78.59 107.73 11.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.844 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -75.32 0.26 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.7 2.99 23.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -114.35 15.78 17.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.413 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 36.8 t -80.59 111.2 20.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.646 0.736 . . . . 0.0 110.864 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.6 Cg_endo -69.7 -0.88 7.5 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.694 2.263 . . . . 0.0 112.367 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -101.88 179.76 4.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 34.4 mmm -99.98 139.29 35.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 26.2 m170 -113.17 -78.34 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.13 -63.12 1.91 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.507 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 42.6 t0 -32.71 -45.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.828 0.346 . . . . 0.0 110.926 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -46.91 124.59 8.15 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.608 0.718 . . . . 0.0 110.892 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 145.95 58.82 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.704 2.269 . . . . 0.0 112.333 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.5 t -64.48 144.41 57.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.843 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.457 ' O ' HG23 ' A' ' 465' ' ' THR . 24.2 ttpt -79.33 -67.15 0.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.1 mt -44.63 -59.17 2.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -39.67 -25.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.479 ' N ' ' O ' ' A' ' 462' ' ' LEU . 29.9 m170 -99.89 -51.72 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 461' ' ' LYS . 44.5 p -35.58 -44.38 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.195 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 68.3 p -123.35 -35.03 3.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.37 -37.65 1.96 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.489 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -109.96 147.74 32.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.86 0.362 . . . . 0.0 110.855 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 38.2 t -103.2 147.56 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.879 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.443 HG23 ' N ' ' A' ' 471' ' ' ASN . 4.5 tp -70.6 -42.36 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 471' ' ' ASN . . . . . 0.443 ' N ' HG23 ' A' ' 470' ' ' ILE . 8.0 t-20 -51.91 -54.71 26.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 121.63 -153.24 16.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.434 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.44 -19.15 59.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.321 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -101.41 42.7 1.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.95 143.61 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.438 ' HE2' ' CZ ' ' A' ' 440' ' ' TYR . 5.3 ppp? -80.93 19.32 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.415 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 26.3 m-85 -126.38 158.61 35.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.882 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 13.2 m -76.47 120.29 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -100.84 32.66 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.821 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -77.71 161.51 71.45 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.588 0.709 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 116.93 4.79 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.712 2.275 . . . . 0.0 112.311 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.624 HD13 ' HG2' ' A' ' 487' ' ' ARG . 28.6 mt -40.98 150.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.2 p -133.27 154.92 50.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.154 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -40.48 -33.26 0.25 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -80.16 -74.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.521 ' HA ' HD12 ' A' ' 489' ' ' LEU . 32.1 p -46.95 -52.98 13.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.624 ' HG2' HD13 ' A' ' 482' ' ' LEU . 0.0 OUTLIER -40.96 -44.55 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -59.64 -38.29 80.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 486' ' ' THR . 55.0 mt -52.21 -65.54 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.936 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 78.1 mt -42.25 -57.59 2.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -39.89 -42.31 1.31 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -79.53 -48.32 14.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.913 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -51.5 -58.76 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 97.2 mt -40.98 -47.95 3.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.925 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.67 -43.36 93.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.099 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -60.26 -43.73 95.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -63.31 -63.96 1.04 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -50.18 -56.27 11.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.102 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -49.0 -57.95 5.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.902 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.37 -52.36 28.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 99.04 -83.49 0.61 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.426 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -135.67 175.35 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.766 0.317 . . . . 0.0 111.085 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -56.38 146.38 24.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -140.69 155.67 46.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.827 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -64.0 129.39 39.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -119.99 -45.77 2.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.888 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -129.42 92.08 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.869 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.65 13.95 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -140.15 134.09 30.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -96.89 166.64 11.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.884 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.555 HD12 ' N ' ' A' ' 512' ' ' LYS . 4.1 pp -122.95 -42.18 2.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.91 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.555 ' N ' HD12 ' A' ' 511' ' ' LEU . 38.2 pttt -85.04 43.37 1.0 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.882 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 105.05 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.965 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 47.8 t -76.71 129.39 36.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -133.78 -163.18 10.29 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.505 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 163.9 36.6 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.332 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 56.5 p -126.78 38.0 4.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.88 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 87.6 p -58.46 170.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.827 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 CA-C-O 119.118 -0.823 . . . . 0.0 112.514 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 2.3 m -112.2 131.19 55.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.891 0.377 . . . . 0.0 110.885 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 34.9 p -58.28 175.32 0.23 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.831 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -128.45 166.58 20.94 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.505 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 59.2 p -132.31 153.58 50.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 110.852 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 71.3 m -97.35 -58.05 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.84 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 48.98 69.2 1.05 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.49 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -108.68 138.97 44.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.847 0.356 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.47 156.8 40.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.591 0.71 . . . . 0.0 110.958 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.65 2.57 3.35 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.35 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -94.0 128.66 40.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp -85.97 152.02 23.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.864 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -123.62 46.21 2.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -114.45 165.72 12.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.562 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 27.2 tp -71.71 115.92 11.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.54 125.22 22.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -66.26 -3.76 6.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -100.08 -55.36 2.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.559 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 10.2 t80 -43.91 -36.36 2.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 39.5 mt -43.74 -38.44 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -35.02 9.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.53 -9.78 11.64 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -99.73 96.16 7.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.891 0.377 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 36.5 t -130.64 102.16 6.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.095 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -67.69 82.71 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -78.73 -57.47 3.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.058 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.88 -2.03 31.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.956 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 36.0 m-20 -134.85 37.49 3.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 53.2 t -80.76 111.04 19.87 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 110.896 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.4 Cg_endo -69.71 -2.5 10.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.712 2.275 . . . . 0.0 112.342 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -108.31 -177.24 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.893 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 38.3 mmm -100.26 147.78 25.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 23.4 m170 -122.57 -77.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.438 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.68 -65.73 1.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.488 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.4 m-20 -34.73 -39.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.562 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.7 t80 -50.44 124.59 18.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 0.0 110.826 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 141.08 44.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.339 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.0 t -65.9 141.07 58.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -78.01 -66.8 0.8 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.884 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.1 mt -45.37 -56.67 4.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -40.81 -24.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.502 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 40.9 m-70 -100.61 -53.66 3.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.862 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 464' ' ' HIS . 69.8 p -31.1 -41.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.15 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.431 ' N ' ' O ' ' A' ' 464' ' ' HIS . 39.2 p -129.81 -36.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 136.22 -37.85 1.84 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -106.66 142.74 35.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -100.51 144.45 29.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.6 tp -71.9 -36.57 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.149 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -52.21 -60.03 3.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.921 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 125.72 -156.01 19.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.512 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -71.97 -27.59 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 110.89 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -101.47 44.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -73.91 146.48 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.1 ppp? -80.6 17.52 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 25.4 m-85 -128.23 154.81 45.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.9 m -78.55 126.9 31.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -100.11 19.2 16.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.86 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.28 155.14 58.89 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.596 0.712 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 116.17 4.43 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.74 2.293 . . . . 0.0 112.324 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.623 HD11 ' CD1' ' A' ' 490' ' ' LEU . 12.7 mt -40.61 132.41 2.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.52 ' O ' ' CB ' ' A' ' 487' ' ' ARG . 69.2 p -112.71 167.13 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -49.61 -31.86 11.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -81.26 -77.0 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.885 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 49.9 p -45.62 -36.94 5.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.152 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 483' ' ' THR . 12.5 tpt180 -48.71 -40.92 30.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.859 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -61.45 -45.76 92.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 45.1 mt -41.41 -67.01 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.623 ' CD1' HD11 ' A' ' 482' ' ' LEU . 77.4 mt -40.78 -59.41 1.41 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -39.7 -41.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.87 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -79.63 -50.58 10.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.3 tmm? -57.93 -62.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 495' ' ' ALA . 80.7 mt -45.27 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.926 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' A' ' 494' ' ' LEU . . . -36.36 -46.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.096 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -58.7 -53.02 63.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.406 ' O ' ' C ' ' A' ' 498' ' ' ALA . 4.9 t0 -64.1 -65.87 0.62 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' A' ' 501' ' ' GLY . . . -37.47 -64.98 0.34 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 498' ' ' ALA . 10.4 tm-20 -36.08 -53.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -84.3 40.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 498' ' ' ALA . . . 139.96 100.92 0.47 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.494 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -161.18 126.06 3.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.737 0.303 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.66 87.18 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -87.12 171.17 10.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.837 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' GLU . . . . . 0.426 ' O ' ' C ' ' A' ' 506' ' ' LYS . 11.1 tp10 -129.52 143.38 50.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 506' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 505' ' ' GLU . 6.3 ptpp? -34.9 148.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -85.5 159.65 19.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 508' ' ' VAL . 9.1 p -117.85 113.74 43.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.114 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -101.39 177.63 4.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -84.94 -75.5 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.3 mp 46.34 33.97 2.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.928 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 46.5 mmtt -131.94 10.64 4.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 49.8 tttt -56.73 132.23 51.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 25.4 m -150.72 176.97 10.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -177.49 83.56 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.457 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -179.08 2.66 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.696 2.264 . . . . 0.0 112.324 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 80.2 p -126.07 175.55 7.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.841 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 40.6 m -117.1 -57.22 2.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.865 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 CA-C-O 119.18 -0.789 . . . . 0.0 112.498 -179.967 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 16.3 m -138.6 142.98 39.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 110.821 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 7.4 t -166.65 110.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 160.19 51.21 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 81.3 p -84.79 137.21 33.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.885 0.374 . . . . 0.0 110.887 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 79.3 p -57.88 -45.55 86.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.877 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 172.77 178.88 43.14 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.513 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -125.39 97.09 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.902 0.382 . . . . 0.0 110.903 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -89.04 153.86 49.35 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.597 0.713 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 82.5 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.676 2.251 . . . . 0.0 112.371 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -144.87 163.78 33.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.5 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 3.7 mmmp? -88.55 -36.73 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.901 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 489' ' ' LEU . 5.7 tpt180 61.01 40.98 14.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -135.12 160.86 37.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.561 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 43.6 tp -60.75 112.92 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 437' ' ' CYS . . . . . 0.5 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 5.9 t -53.24 115.49 1.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -56.03 -12.18 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -101.0 -48.46 4.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.5 ' CB ' ' HB3' ' A' ' 437' ' ' CYS . 25.1 t80 -45.38 -40.75 8.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 54.1 mt -39.95 -31.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.116 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 81.7 p -102.15 -36.6 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.44 11.68 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.487 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -96.96 88.53 4.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.907 0.384 . . . . 0.0 110.848 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 12.6 t -126.37 110.49 13.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.76 -72.05 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.067 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 64.5 mtt180 -73.63 102.41 3.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.1 -72.14 0.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.112 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -76.43 -7.33 54.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.892 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.93 30.26 7.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.892 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 44.7 t -73.97 113.39 22.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.725 . . . . 0.0 110.865 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.3 Cg_endo -69.77 7.11 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.26 . . . . 0.0 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.5 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 49.3 m-85 -118.38 -175.23 2.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 27.4 mmm -101.15 134.85 43.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.425 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.5 m170 -113.58 -76.66 0.58 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.829 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.499 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -77.97 -70.64 1.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.499 ' C ' ' O ' ' A' ' 456' ' ' GLY . 2.6 m-20 -29.54 -42.84 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 0.0 110.862 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.561 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 17.9 t80 -48.16 125.84 11.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.668 0.747 . . . . 0.0 110.866 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 126.99 13.97 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.38 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.7 t -49.88 149.42 2.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -80.11 -67.9 0.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.504 ' O ' ' N ' ' A' ' 464' ' ' HIS . 48.0 mt -43.78 -60.42 1.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.422 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 92.4 t80 -39.22 -25.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.504 ' N ' ' O ' ' A' ' 462' ' ' LEU . 17.2 m170 -99.0 -53.23 3.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 73.4 p -32.61 -43.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.142 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 82.7 p -127.37 -35.92 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.153 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.422 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.02 -40.42 1.45 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -105.04 172.65 6.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.3 t -129.56 119.18 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.905 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -51.94 -30.27 12.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -50.45 -63.35 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 143.57 -162.44 27.67 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.528 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.1 -37.6 75.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.864 0.364 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -99.88 65.14 1.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.887 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 20.9 t -78.18 151.88 32.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.8 ppp? -69.86 -19.41 63.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 20.5 m-85 -101.46 155.99 17.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 35.1 m -78.66 142.92 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.853 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -115.18 35.15 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.22 161.17 80.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.596 0.712 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 116.5 4.59 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.645 2.23 . . . . 0.0 112.348 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 30.0 mt -40.53 146.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.914 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 77.3 p -125.26 156.25 38.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.126 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -40.42 -33.57 0.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -80.46 -75.21 0.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.614 ' HA ' HD12 ' A' ' 489' ' ' LEU . 20.3 p -41.17 -49.52 3.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.18 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -46.92 2.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.97 -45.98 91.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 434' ' ' ARG . 80.7 mt -45.4 -62.24 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.946 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 38.8 mt -41.86 -61.31 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.906 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.8 -47.6 2.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -68.4 -43.47 77.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' MET . . . . . 0.443 ' CE ' HD22 ' A' ' 494' ' ' LEU . 14.5 tmm? -56.92 -60.34 3.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.443 HD22 ' CE ' ' A' ' 493' ' ' MET . 4.0 mm? -54.39 -36.95 64.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -57.07 -41.76 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -50.91 -46.09 60.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.832 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -77.07 -56.0 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.846 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -45.15 -51.94 9.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -55.09 -53.16 59.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -39.12 -47.36 1.55 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.097 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -65.56 -90.21 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.435 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -104.76 175.61 5.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.766 0.317 . . . . 0.0 111.083 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -109.71 147.85 32.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -157.71 165.44 35.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -118.52 127.62 53.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -108.1 159.75 16.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.88 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -157.05 141.72 16.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.882 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.504 HG13 ' O ' ' A' ' 508' ' ' VAL . 3.6 p -126.62 82.54 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.095 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.87 151.54 46.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 510' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 510' ' ' GLU . 1.6 pm0 -98.0 166.9 11.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.86 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 4.1 mp -98.71 -67.54 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.935 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -129.3 80.28 1.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.87 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -96.46 81.11 3.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 74.2 p -172.84 169.39 4.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -171.5 96.52 0.11 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.495 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 179.04 3.98 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.72 2.28 . . . . 0.0 112.321 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 26.3 p -156.59 174.94 14.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 75.2 p -166.17 174.4 9.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 CA-C-O 119.144 -0.809 . . . . 0.0 112.476 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 112.469 -0.253 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 15.8 m -141.98 118.0 10.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 36.8 t -174.99 144.38 0.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -159.91 38.88 0.46 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 5.7 m -102.84 40.7 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.851 0.357 . . . . 0.0 110.858 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 71.6 m -80.02 123.61 27.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 88.64 156.36 31.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.484 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -48.64 143.16 5.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.707 ' N ' HD13 ' A' ' 430' ' ' LEU . 0.0 OUTLIER -128.44 156.59 76.76 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.555 0.693 . . . . 0.0 110.91 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -91.12 0.01 OUTLIER 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -45.29 120.2 2.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.46 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 26.2 mmmt -83.49 -32.59 25.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.755 ' O ' HD22 ' A' ' 489' ' ' LEU . 16.7 tpp180 60.64 35.74 19.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -128.02 176.31 7.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 33.8 tp -75.39 121.87 22.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.962 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 437' ' ' CYS . . . . . 0.45 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.2 t -59.82 131.38 50.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.889 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 2.05 7.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -119.0 -40.56 2.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.455 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 34.5 t80 -54.46 -28.37 43.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.8 mt -45.57 -32.4 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 p -102.31 -29.7 11.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.19 -10.33 17.57 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.497 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -99.98 97.95 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.848 0.356 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 11.6 t -131.63 108.01 9.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.896 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.65 -66.19 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.096 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 19.2 mtm-85 -71.19 104.89 3.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.861 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -77.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -81.7 -2.79 51.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -114.11 24.6 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.3 t -80.18 114.54 47.72 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.873 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.68 3.34 Favored 'Trans proline' 0 C--O 1.231 0.13 0 C-N-CA 122.675 2.25 . . . . 0.0 112.369 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.46 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 75.6 m-85 -115.53 -174.37 2.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 31.8 mmm -100.03 150.19 22.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.877 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.455 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 30.3 m170 -125.65 -77.21 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -81.13 -60.09 2.32 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.465 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -39.32 -43.46 1.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 20.3 t80 -46.61 127.7 8.21 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.662 0.744 . . . . 0.0 110.903 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 140.27 42.14 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.7 146.34 49.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.584 ' NZ ' HD23 ' A' ' 494' ' ' LEU . 34.4 tttp -80.14 -68.72 0.65 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.902 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.7 mt -44.89 -56.85 4.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.443 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 44.7 t80 -40.0 -27.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.554 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 32.5 m-70 -98.63 -52.69 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 461' ' ' LYS . 31.9 p -34.21 -35.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 464' ' ' HIS . 76.8 p -132.74 -39.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.124 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.443 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.82 -38.99 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.501 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -109.14 152.16 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.859 0.362 . . . . 0.0 110.895 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 37.9 t -105.35 141.44 36.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.1 tp -72.91 -31.94 37.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -50.83 -68.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 144.45 -157.19 27.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.51 -29.06 61.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.779 0.323 . . . . 0.0 110.864 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.51 53.91 0.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.2 t -73.61 148.47 42.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.487 ' SD ' ' CZ ' ' A' ' 477' ' ' PHE . 4.4 ppp? -79.3 11.05 3.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.881 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.487 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 12.6 m-85 -124.59 158.1 33.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 2.8 m -76.8 134.02 39.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -109.33 20.27 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.826 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' ASP . . . . . 0.413 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 0.0 OUTLIER -67.79 158.92 81.63 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.601 0.715 . . . . 0.0 110.86 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 481' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.1 Cg_endo -69.73 117.85 5.33 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.672 2.248 . . . . 0.0 112.374 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.554 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 88.8 mt -39.29 140.1 0.46 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 12.1 p -120.44 154.56 35.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -41.1 -29.12 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -79.97 -75.56 0.25 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.89 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.2 p -46.25 -47.88 18.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.121 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -39.68 -39.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.25 -38.91 91.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 434' ' ' ARG . 84.2 mt -50.44 -61.66 2.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 57.1 mt -41.43 -55.72 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -39.71 -45.37 1.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.861 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.17 -36.87 39.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -65.27 -66.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.584 HD23 ' NZ ' ' A' ' 461' ' ' LYS . 16.2 mt -40.07 -49.02 2.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.65 97.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.36 -48.26 79.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.845 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -64.92 -69.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -43.4 -49.1 7.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.087 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.59 -58.36 7.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -85.0 96.58 9.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.09 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -100.51 40.83 2.3 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -150.96 123.7 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.087 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.25 107.32 5.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -44.58 164.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -120.06 176.03 5.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -118.9 161.0 20.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLU . . . . . 0.469 ' HG2' ' N ' ' A' ' 508' ' ' VAL . 23.0 tt0 -127.57 149.97 49.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.873 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.469 ' N ' ' HG2' ' A' ' 507' ' ' GLU . 2.7 p -92.34 121.62 43.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.161 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -92.56 140.62 29.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -46.0 154.44 0.24 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' A' ' 512' ' ' LYS . 54.0 mt -90.48 47.96 1.49 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER 35.66 39.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.02 122.97 4.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 89.1 p -165.45 171.39 13.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.871 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 145.32 89.69 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.512 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -176.54 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.65 2.233 . . . . 0.0 112.361 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 49.1 m -107.22 168.34 9.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 35.6 t -135.06 162.26 32.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.856 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 CA-C-O 119.152 -0.804 . . . . 0.0 112.49 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 43.4 t -49.41 -43.22 44.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.847 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 67.0 m -77.27 154.68 32.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.873 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 121.46 82.96 0.69 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.493 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 8.0 m -133.47 141.82 47.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.902 0.382 . . . . 0.0 110.867 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 25.5 p -95.12 135.97 36.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 168.21 70.48 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.473 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -85.66 116.07 23.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.88 0.372 . . . . 0.0 110.939 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.71 155.82 73.19 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.583 0.706 . . . . 0.0 110.939 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 3.7 2.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.673 2.249 . . . . 0.0 112.319 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -86.0 -176.68 6.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.934 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -144.09 135.97 26.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.401 ' C ' ' CD ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -91.28 33.65 0.97 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -107.99 143.94 35.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.578 HD13 ' CD2' ' A' ' 458' ' ' PHE . 31.7 tp -66.98 120.66 14.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 33.3 t -59.12 134.02 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -79.37 12.08 2.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -117.71 -41.94 2.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -59.14 -33.41 70.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 70.6 mt -42.83 -33.0 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.4 p -101.48 -37.13 8.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.138 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.5 -8.42 17.58 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -100.13 80.97 2.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.897 0.38 . . . . 0.0 110.865 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 47.1 t -118.56 104.62 10.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.96 -64.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 79.3 mtt180 -78.21 105.56 9.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.852 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.42 -77.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.91 14.3 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.838 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -113.29 -17.25 12.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.856 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 8.0 t -65.95 111.21 5.9 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.552 0.692 . . . . 0.0 110.895 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 3.64 2.62 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.349 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -100.17 170.69 8.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 17.6 mmm -81.94 141.28 33.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -120.91 -77.61 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.8 -60.17 2.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.7 m-20 -34.45 -46.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.775 0.321 . . . . 0.0 110.832 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.578 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.6 t80 -46.65 126.21 8.09 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.664 0.745 . . . . 0.0 110.855 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 134.42 27.94 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.688 2.258 . . . . 0.0 112.331 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.4 t -53.16 145.19 14.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.484 ' O ' HG23 ' A' ' 465' ' ' THR . 21.0 tttm -80.12 -67.64 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.6 mt -44.76 -58.83 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.942 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.449 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 25.1 t80 -39.43 -25.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.96 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.516 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 30.4 m-70 -99.98 -54.15 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 461' ' ' LYS . 33.8 p -33.79 -40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 80.6 p -126.92 -33.18 2.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.127 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.449 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 131.81 -40.24 1.66 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.505 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -109.8 149.92 29.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 0.0 110.899 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.62 143.8 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.8 tp -71.34 -39.09 71.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.096 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.74 -68.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 141.58 -154.81 24.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.498 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -74.38 -24.49 59.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -101.69 49.27 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -79.26 148.08 32.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.522 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 3.6 ppp? -80.57 17.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.522 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 12.4 m-85 -129.43 157.38 42.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.5 p -80.07 128.68 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.877 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -103.87 21.94 15.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.46 158.67 86.26 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.614 0.721 . . . . 0.0 110.845 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 119.28 6.26 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.665 2.243 . . . . 0.0 112.387 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.516 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 39.8 mt -42.5 150.2 0.15 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.947 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.0 p -128.79 154.9 45.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.145 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -39.92 -30.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -80.66 -75.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 489' ' ' LEU . 20.7 p -46.99 -46.84 21.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.146 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -43.58 1.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -58.29 -40.5 82.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.937 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' A' ' 486' ' ' THR . 48.6 mt -49.87 -64.29 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 482' ' ' LEU . 85.2 mt -42.99 -54.0 4.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -41.38 -44.9 2.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -78.07 -59.18 2.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -44.19 -60.14 2.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.895 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 55.4 mt -41.39 -59.87 1.45 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -49.37 -52.32 29.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.109 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -42.43 -56.57 2.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.431 ' O ' ' C ' ' A' ' 498' ' ' ALA . 10.7 t0 -73.73 -63.69 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.86 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -33.59 -38.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -78.09 -61.21 2.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . 40.31 39.83 0.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.123 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -52.69 -43.85 59.97 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.46 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -121.57 85.22 2.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.776 0.322 . . . . 0.0 111.099 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -107.55 111.16 23.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.43 87.37 6.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.888 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -47.43 153.44 0.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.877 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -158.17 105.0 1.9 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -94.13 107.58 19.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.927 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -75.21 85.31 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.138 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -50.97 141.3 13.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -48.08 149.86 1.33 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.765 ' H ' HD13 ' A' ' 511' ' ' LEU . 0.0 OUTLIER -80.74 36.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? 46.69 40.84 9.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.92 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -40.1 150.04 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.86 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 33.1 p -144.94 176.87 9.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -175.98 104.73 0.19 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.473 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 -176.1 1.38 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.657 2.238 . . . . 0.0 112.361 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 53.8 p -156.34 177.37 11.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.842 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 79.7 p -157.61 173.08 17.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 CA-C-O 119.14 -0.811 . . . . 0.0 112.485 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 80.1 p -121.58 109.95 15.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.844 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 16.7 m -118.07 107.02 13.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.926 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -104.67 128.39 9.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 4.0 t -126.66 160.85 29.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.862 0.363 . . . . 0.0 110.893 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 427' ' ' SER . . . . . 0.421 ' HB2' ' NH2' ' A' ' 434' ' ' ARG . 52.8 p -103.3 83.21 2.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.854 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 65.49 115.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.497 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -79.34 44.91 0.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.869 0.366 . . . . 0.0 110.888 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.531 ' O ' HD23 ' A' ' 430' ' ' LEU . 0.6 OUTLIER -158.08 159.26 30.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.582 0.706 . . . . 0.0 110.927 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 97.48 0.64 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.663 2.242 . . . . 0.0 112.341 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -150.43 149.25 29.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -124.97 138.15 54.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.901 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.465 ' CG ' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -105.67 47.59 0.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.844 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -124.82 143.7 50.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.881 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 458' ' ' PHE . 20.6 tp -73.59 102.65 3.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.89 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.8 t -40.02 124.1 1.76 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.883 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -68.05 -3.02 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -102.37 -51.52 3.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -47.78 -37.77 14.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.963 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.7 mt -41.17 -31.09 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.123 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 40.6 p -103.05 -33.93 9.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.94 -10.47 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.497 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -99.97 97.82 8.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 110.902 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.67 110.2 9.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.878 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.092 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.432 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 68.4 mtt180 -77.5 109.54 11.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.841 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.62 -77.16 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.125 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.74 5.8 17.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -103.29 -20.07 14.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.922 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 10.2 t -60.86 110.26 2.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.611 0.719 . . . . 0.0 110.872 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.4 Cg_endo -69.75 4.27 2.29 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.8 178.33 4.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.918 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 22.7 mmm -91.62 140.42 29.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -120.59 -76.17 0.58 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.49 -64.95 1.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.495 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 28.0 t0 -32.6 -48.01 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.82 0.343 . . . . 0.0 110.871 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.9 t80 -40.55 125.92 1.84 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.759 . . . . 0.0 110.886 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 155.74 65.05 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.637 2.225 . . . . 0.0 112.36 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.0 t -73.5 146.03 45.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.913 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 465' ' ' THR . 45.5 tttp -79.54 -69.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.3 mt -44.14 -59.56 2.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.432 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 58.3 t80 -39.56 -25.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.547 ' CE1' HD21 ' A' ' 482' ' ' LEU . 30.6 m170 -98.94 -50.83 4.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.823 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 464' ' ' HIS . 55.2 p -35.59 -43.24 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 32.5 p -125.96 -33.75 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.158 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.432 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 135.15 -38.12 1.84 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.514 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -108.56 166.24 10.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.2 t -126.25 131.77 51.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 470' ' ' ILE . 5.4 tp -80.66 21.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -99.57 -46.89 5.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 114.81 174.31 18.24 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.503 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.5 -17.38 13.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -101.56 43.49 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.83 146.18 44.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.6 ppp? -71.59 -22.05 61.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.854 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 16.9 m-85 -100.55 159.19 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.6 m -79.94 135.9 36.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -101.02 24.46 9.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -62.51 153.44 77.16 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.582 0.705 . . . . 0.0 110.876 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 119.94 6.81 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.693 2.262 . . . . 0.0 112.355 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.556 HD21 HD11 ' A' ' 490' ' ' LEU . 80.0 mt -41.18 143.73 0.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 10.7 p -138.65 162.0 35.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.105 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -39.46 -35.63 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -80.22 -68.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.853 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 489' ' ' LEU . 5.7 p -52.89 -55.13 25.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.154 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.29 -49.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -52.24 -39.18 59.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.465 ' CD2' ' CG ' ' A' ' 434' ' ' ARG . 65.1 mt -49.6 -65.89 0.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.556 HD11 HD21 ' A' ' 482' ' ' LEU . 72.7 mt -39.81 -61.12 0.88 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.917 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.91 -39.56 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.842 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -79.47 -40.89 28.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -62.21 -59.76 4.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.872 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.88 -45.56 30.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.087 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -54.41 -40.62 68.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.833 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.69 -62.72 1.28 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.791 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -50.53 -61.17 2.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.081 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' A' ' 498' ' ' ALA . 15.8 tp10 -34.56 -51.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.5 96.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.136 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -173.35 -68.8 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -122.12 134.64 54.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 0.0 111.126 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -69.97 81.18 0.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -110.22 114.5 28.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -113.74 103.4 11.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 15.0 pttm -116.69 167.77 10.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.941 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -149.27 145.04 26.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 508' ' ' VAL . 10.8 p -80.53 115.99 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.17 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -62.51 167.92 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.89 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 130.26 40.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.873 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 77.6 mt -115.95 -41.71 3.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -89.81 38.83 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -87.0 107.07 18.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.925 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 3.9 t -132.58 172.54 12.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.826 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -140.79 167.43 25.61 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 128.43 15.99 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.705 2.27 . . . . 0.0 112.337 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 71.3 m -82.75 159.1 22.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.849 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 15.2 m -110.5 149.12 30.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.513 -179.999 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 20.5 m -152.42 145.96 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 80.4 p -141.3 144.15 34.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 114.86 59.55 0.37 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 88.7 p -84.89 -47.18 10.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 9.1 t -112.67 131.82 55.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -139.31 50.37 0.79 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.511 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -125.55 90.32 3.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.918 0.39 . . . . 0.0 110.861 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.07 158.56 69.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.634 0.731 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.11 3.82 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.686 2.257 . . . . 0.0 112.347 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -144.61 178.85 7.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 452' ' ' PRO . 41.2 mttt -137.13 144.05 42.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.412 ' HD3' ' O ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -97.76 33.78 2.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.893 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -115.84 149.18 39.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.894 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.515 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.7 tp -79.39 105.45 10.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 23.5 t -41.79 131.48 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -80.95 21.79 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.901 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -125.33 -42.2 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.905 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -64.01 -27.7 69.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 96.5 mt -44.72 -37.19 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.3 -27.76 13.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.177 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.62 -10.17 16.45 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -100.73 105.76 17.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.891 0.377 . . . . 0.0 110.884 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 40.4 t -138.45 122.26 17.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.869 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -46.18 -67.45 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.155 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -86.12 114.47 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.64 -79.17 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.155 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -81.74 12.79 3.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -116.55 1.73 12.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 12.9 t -80.18 110.99 18.54 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.621 0.724 . . . . 0.0 110.866 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.47 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.3 Cg_endo -69.77 7.08 1.08 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -99.25 -177.15 3.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 44.3 mmm -97.84 126.25 43.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.873 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -109.95 -74.89 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.51 -60.28 2.37 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.458 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 51.6 m-20 -34.48 -45.46 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.858 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.515 ' CD2' HD13 ' A' ' 436' ' ' LEU . 27.8 t80 -47.03 128.77 9.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.654 0.74 . . . . 0.0 110.879 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 150.79 68.92 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.323 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.405 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.6 t -75.72 150.07 37.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 465' ' ' THR . 9.3 ttmt -80.01 -68.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.5 mt -45.5 -57.54 4.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 64.5 t80 -40.71 -24.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.565 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.9 m-70 -99.9 -53.39 3.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 461' ' ' LYS . 43.6 p -34.7 -43.48 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.105 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 72.2 p -124.68 -35.23 2.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.13 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 136.46 -38.57 1.75 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.531 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -107.09 169.83 8.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 16.8 t -124.56 133.76 53.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.39 -38.84 82.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -50.28 -54.83 18.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 124.16 -159.35 18.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.449 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.77 -25.11 61.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.775 0.321 . . . . 0.0 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -99.95 47.21 0.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 33.9 t -78.1 149.41 33.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.6 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -80.66 18.54 0.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.6 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 20.2 m-85 -131.39 156.05 46.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.4 m -79.0 128.33 33.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.86 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -103.02 25.13 9.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.831 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.23 160.3 79.44 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.593 0.711 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 116.84 4.75 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.647 2.232 . . . . 0.0 112.359 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.565 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 37.8 mt -40.18 144.85 0.19 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 72.3 p -131.91 160.26 36.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -41.32 -32.67 0.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -78.27 -71.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.5 p -48.91 -51.15 31.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.126 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.47 -52.61 2.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.855 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -51.04 -49.7 60.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 94.2 mt -43.9 -65.18 0.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 35.9 mt -40.01 -57.32 1.66 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.7 -40.4 5.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.81 -52.43 9.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.3 tmm? -53.83 -64.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 18.3 mt -47.87 -56.39 7.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.933 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.17 -55.61 9.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.093 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.04 -48.57 75.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -38.76 -60.59 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.903 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -79.07 -56.26 4.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.059 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.434 ' C ' ' O ' ' A' ' 498' ' ' ALA . 12.5 tp10 -35.43 -45.6 0.34 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.88 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -34.51 98.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.077 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -125.28 -65.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.494 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -87.77 177.8 6.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.725 0.298 . . . . 0.0 111.112 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -147.86 160.23 43.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -166.32 119.5 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.52 169.44 14.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.864 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 17.7 mtmm -83.26 170.21 14.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -130.96 170.3 14.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 508' ' ' VAL . 7.9 p -120.6 110.3 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.133 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -67.84 160.66 27.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.925 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.07 148.29 44.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -52.55 -173.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 513' ' ' LYS . 0.1 OUTLIER -74.65 50.76 0.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.915 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 513' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 512' ' ' LYS . 38.8 tttm -38.01 124.88 1.2 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.904 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 1.4 t -168.41 168.31 11.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.886 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -174.1 134.34 2.81 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.483 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -175.03 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.719 2.28 . . . . 0.0 112.355 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 67.6 m -153.8 140.48 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.865 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 14.9 m -117.77 171.4 8.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.861 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.489 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 17.3 t -111.22 139.67 46.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.854 0.359 . . . . 0.0 110.817 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 60.5 p -99.87 160.48 14.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.841 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -105.26 -101.2 2.69 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 3.8 m -114.44 138.69 50.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 20.6 t -89.78 -44.6 9.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 166.75 149.84 6.15 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.506 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -112.14 151.28 29.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.0 110.884 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.63 154.35 42.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.605 0.717 . . . . 0.0 110.9 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -0.29 6.69 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.694 2.263 . . . . 0.0 112.304 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -82.95 171.6 13.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.924 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -120.59 136.54 54.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.91 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.543 ' HB3' HD23 ' A' ' 489' ' ' LEU . 8.2 mpt_? -92.63 41.67 1.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -122.12 152.68 39.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.52 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 13.4 tp -78.93 115.75 18.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 27.0 t -45.68 131.11 9.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -75.24 0.55 16.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -108.17 -50.11 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.434 ' CE2' ' HE1' ' A' ' 476' ' ' MET . 11.7 t80 -49.05 -30.05 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.8 mt -44.46 -33.75 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.086 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 60.2 p -103.91 -29.23 11.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.107 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.11 -10.11 22.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -98.6 99.38 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.86 104.81 5.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.44 -61.78 0.87 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.134 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -81.92 104.64 12.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.08 -74.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.087 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -81.42 2.7 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.899 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -104.51 -5.26 21.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.3 t -72.56 111.59 11.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.624 0.726 . . . . 0.0 110.864 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 2.02 3.88 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.688 2.259 . . . . 0.0 112.388 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -100.32 -174.64 2.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 29.1 mmm -98.19 142.34 29.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.877 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -121.23 -75.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.469 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.69 -66.28 1.65 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.43 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.469 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -33.0 -42.57 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.863 0.363 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.52 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.8 t80 -46.79 126.93 8.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.684 0.754 . . . . 0.0 110.861 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 144.94 55.45 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.255 . . . . 0.0 112.333 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 51.9 t -69.26 143.24 53.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.429 ' O ' HG23 ' A' ' 465' ' ' THR . 4.7 ttpm? -79.38 -65.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.89 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.5 mt -45.0 -57.84 3.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -40.51 -24.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.595 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 27.2 m170 -100.66 -52.49 3.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.458 ' C ' ' O ' ' A' ' 464' ' ' HIS . 58.3 p -32.24 -42.28 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.158 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 62.8 p -127.84 -36.92 1.97 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.15 -33.18 2.56 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.475 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -116.81 143.73 45.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.839 0.352 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.4 t -101.92 107.33 18.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.6 tp -40.49 -36.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.185 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -53.2 -61.87 2.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 107.45 -142.07 15.74 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.18 13.43 2.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.841 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -106.72 -25.22 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.895 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -43.14 125.87 3.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.605 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 0.8 OUTLIER -81.56 27.2 0.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.1 m-85 -125.29 158.1 34.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.6 m -80.12 137.68 36.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.831 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 38.0 m170 -108.59 17.98 21.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -60.31 153.43 58.78 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 117.13 4.9 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.709 2.273 . . . . 0.0 112.351 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 490' ' ' LEU . 23.7 mt -39.65 151.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 40.5 p -139.18 165.58 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.113 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' GLU . . . . . 0.43 ' HG3' ' CD ' ' A' ' 485' ' ' GLU . 9.9 pt-20 -40.27 -38.5 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.43 ' CD ' ' HG3' ' A' ' 484' ' ' GLU . 48.0 mp0 -80.43 -76.3 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.915 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.446 ' O ' ' N ' ' A' ' 489' ' ' LEU . 17.4 p -41.49 -50.92 3.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.124 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.474 ' HD3' HD13 ' A' ' 482' ' ' LEU . 12.0 tpt180 -39.41 -44.36 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.15 -40.08 80.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 434' ' ' ARG . 88.3 mt -46.68 -68.14 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 482' ' ' LEU . 92.8 mt -40.43 -57.55 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -42.54 -36.11 1.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -80.17 -38.47 31.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -68.88 -62.64 1.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.829 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -39.9 -49.18 2.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.896 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.79 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.093 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -47.81 -41.3 23.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.861 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 500' ' ' ALA . 8.5 t70 -68.72 -66.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -48.78 -61.87 1.81 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.144 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' A' ' 500' ' ' ALA . 27.0 mt-10 -59.04 -50.19 75.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 497' ' ' ASP . . . 37.2 42.1 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.116 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 179.58 48.71 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.493 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -122.2 78.84 1.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -123.44 82.25 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.876 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -100.03 94.49 6.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.83 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -48.9 119.06 2.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.23 115.18 17.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.74 108.87 0.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.83 92.8 2.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.106 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 172.46 6.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -114.31 151.46 32.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.855 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.473 ' H ' HD12 ' A' ' 511' ' ' LEU . 5.6 mp -53.95 -173.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.931 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -74.75 49.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.939 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -45.84 131.72 9.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.91 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 58.8 m -167.0 162.64 15.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.832 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -116.83 115.81 3.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.497 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.1 69.16 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.233 . . . . 0.0 112.359 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.4 t -122.67 158.95 28.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 23.5 m -111.45 173.27 6.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.856 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 CA-C-O 119.183 -0.787 . . . . 0.0 112.449 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 93.8 p -95.13 135.97 36.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.863 0.363 . . . . 0.0 110.894 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 3.3 t -86.21 137.93 32.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.867 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -101.56 86.02 0.58 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.439 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 95.3 p -82.49 43.22 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.847 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 57.7 m -107.06 149.15 27.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 158.89 57.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.514 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -84.56 101.02 11.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.828 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -101.15 150.75 37.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 0.0 110.9 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -91.55 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.664 2.243 . . . . 0.0 112.386 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -80.28 175.92 10.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.896 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -94.9 -23.0 17.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 57.48 42.08 25.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -138.32 154.29 48.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.624 HD13 ' CD2' ' A' ' 458' ' ' PHE . 32.8 tp -79.54 105.09 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.7 t -40.52 123.78 1.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -69.41 -3.16 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -105.28 -51.43 3.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.423 ' HB2' ' NE2' ' A' ' 455' ' ' HIS . 31.6 t80 -44.58 -37.64 3.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -41.03 -36.24 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.147 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 11.1 p -101.21 -35.23 9.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.99 -9.81 11.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.489 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 444' ' ' PHE . . . . . 0.462 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 5.5 t80 -95.31 83.25 3.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.904 0.383 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 22.1 t -118.42 113.93 22.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -43.95 -72.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.114 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 84.2 mtt85 -80.17 109.41 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.65 -73.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -76.06 -5.66 47.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -110.47 20.34 17.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 37.6 t -80.53 111.81 25.99 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.629 0.728 . . . . 0.0 110.909 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 1.43 4.46 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.691 2.261 . . . . 0.0 112.359 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -105.67 -176.08 2.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' MET . . . . . 0.484 ' CE ' ' HB2' ' A' ' 457' ' ' ASP . 29.1 mmm -100.78 140.58 34.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.924 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.423 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.4 m170 -119.9 -75.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -78.13 -67.3 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.484 ' HB2' ' CE ' ' A' ' 454' ' ' MET . 7.5 m-20 -32.99 -44.72 0.12 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.856 0.36 . . . . 0.0 110.884 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.624 ' CD2' HD13 ' A' ' 436' ' ' LEU . 15.2 t80 -45.28 126.24 5.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.633 0.73 . . . . 0.0 110.897 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 143.58 51.48 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.699 2.266 . . . . 0.0 112.341 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.432 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.1 t -70.69 145.03 50.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 19.9 ttpp -77.25 -64.99 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.8 mt -44.73 -59.44 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.446 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 87.5 t80 -39.62 -25.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 462' ' ' LEU . 42.9 m-70 -98.87 -53.61 3.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.885 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 464' ' ' HIS . 51.2 p -34.48 -34.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.126 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.0 p -133.59 -40.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.124 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.446 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 141.22 -38.57 1.52 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.46 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.43 152.1 30.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.1 t -102.26 141.73 34.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.446 HG22 HD13 ' A' ' 462' ' ' LEU . 8.3 tp -80.23 -26.08 11.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -50.92 -49.61 59.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 129.64 -167.17 21.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.478 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.49 -35.79 79.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.831 0.348 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -100.57 58.8 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.66 149.08 40.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.934 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -76.51 6.57 5.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 15.7 m-85 -125.78 154.74 42.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.844 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 23.3 m -80.37 141.44 35.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.25 26.98 10.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -64.97 153.76 88.02 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.624 0.726 . . . . 0.0 110.869 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 109.66 2.35 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.698 2.266 . . . . 0.0 112.39 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.447 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 47.4 mt -39.73 152.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' N ' ' A' ' 485' ' ' GLU . 72.5 p -137.46 158.51 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -38.95 -30.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.858 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.2 mm-40 -81.4 -74.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.42 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.1 p -46.24 -47.61 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.14 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.11 -47.04 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.86 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -56.99 -41.38 78.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 486' ' ' THR . 74.1 mt -47.66 -63.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 494' ' ' LEU . 72.1 mt -39.87 -60.03 1.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.929 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -40.26 -45.94 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.883 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 44.3 tttp -72.42 -49.11 35.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -48.23 -59.22 3.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 490' ' ' LEU . 4.0 mm? -45.79 -47.07 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.44 ' O ' ' C ' ' A' ' 496' ' ' ASP . . . -66.91 -65.62 0.66 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.095 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 496' ' ' ASP . . . . . 0.44 ' C ' ' O ' ' A' ' 495' ' ' ALA . 1.9 m-20 -34.47 -48.59 0.36 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -40.28 -62.15 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -74.3 -55.51 5.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.099 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 498' ' ' ALA . 1.7 tm-20 -36.79 -42.41 0.38 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -42.25 98.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -110.61 -47.18 0.8 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.471 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.63 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.762 0.315 . . . . 0.0 111.09 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -134.63 -34.06 0.94 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.916 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -78.02 110.53 13.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.84 138.33 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -134.92 107.15 7.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -164.48 133.71 3.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 4.1 p -112.64 120.35 62.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.115 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -100.71 134.86 43.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -99.72 152.03 20.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.704 HD12 ' O ' ' A' ' 511' ' ' LEU . 3.9 pp -110.53 41.96 1.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 65.82 41.59 3.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -54.05 164.57 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.953 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 18.5 m 66.32 45.09 2.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.831 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -60.15 156.92 28.61 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.473 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 136.24 32.37 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.252 . . . . 0.0 112.352 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 57.8 m -114.72 109.87 18.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 15.8 t -74.02 -59.57 2.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.834 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 CA-C-O 119.176 -0.791 . . . . 0.0 112.471 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.458 -0.257 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 4.1 t -146.51 133.52 20.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.844 0.354 . . . . 0.0 110.898 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 48.7 m -134.08 115.31 14.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.872 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -162.39 137.34 4.79 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.546 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 40.5 p -161.9 167.52 24.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 110.859 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 13.3 t -164.58 154.14 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.829 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 178.95 75.42 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.47 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.57 162.68 26.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.902 0.382 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 18.9 mt -149.09 140.52 14.33 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.569 0.7 . . . . 0.0 110.908 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 81.7 0.8 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 0.0 112.344 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -152.3 176.63 11.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.859 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.467 ' HD3' ' CE2' ' A' ' 453' ' ' TYR . 6.9 mtpt -113.44 -18.75 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.472 ' CG ' HD21 ' A' ' 489' ' ' LEU . 0.1 OUTLIER 58.83 38.35 24.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.85 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.04 135.14 32.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.739 HD13 ' CD2' ' A' ' 458' ' ' PHE . 53.9 tp -60.61 117.42 5.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 28.3 t -58.86 126.4 27.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.841 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.32 29.03 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -134.61 -42.09 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.605 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 47.1 t80 -66.91 -21.86 65.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.905 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 61.7 mt -52.84 -32.8 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.143 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 61.1 p -108.26 11.29 27.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.57 -8.73 25.67 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -99.67 99.62 10.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.3 t -136.26 117.25 14.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.09 -67.59 0.27 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.081 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -85.72 114.41 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.21 -76.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.128 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -81.41 -2.57 49.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -105.59 11.99 31.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 20.1 t -80.81 111.32 22.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.631 0.729 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 0.77 5.2 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.675 2.25 . . . . 0.0 112.331 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.467 ' CE2' ' HD3' ' A' ' 433' ' ' LYS . 57.6 m-85 -100.3 -174.97 2.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.4 mmm -100.54 143.03 31.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.922 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 440' ' ' TYR . 13.6 m170 -122.04 -75.28 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.64 -69.44 1.4 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.466 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.491 ' C ' ' O ' ' A' ' 456' ' ' GLY . 20.3 t0 -31.05 -41.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.739 ' CD2' HD13 ' A' ' 436' ' ' LEU . 14.7 t80 -49.31 117.78 7.16 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.864 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 129.45 17.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.721 2.281 . . . . 0.0 112.311 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 138.17 13.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -73.99 -66.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 49.0 mt -45.02 -58.7 3.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' A' ' 467' ' ' GLY . 69.4 t80 -39.74 -24.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.498 ' O ' ' C ' ' A' ' 465' ' ' THR . 20.9 m80 -100.75 -53.19 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.826 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.4 p -29.64 -42.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.193 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 464' ' ' HIS . 65.9 p -126.66 -39.53 1.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 463' ' ' TYR . . . 146.72 -38.06 1.16 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.51 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 468' ' ' ASN . . . . . 0.411 ' C ' ' HA ' ' A' ' 463' ' ' TYR . 45.1 p-10 -113.83 168.93 9.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.855 0.359 . . . . 0.0 110.918 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.33 140.38 48.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.448 HG22 HD13 ' A' ' 462' ' ' LEU . 7.9 tp -76.98 -33.28 20.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.102 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -50.42 -65.46 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 145.87 -164.35 28.2 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.502 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.15 -22.63 59.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.822 0.344 . . . . 0.0 110.888 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -99.76 48.89 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -79.46 141.32 36.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.605 ' CE ' ' CE2' ' A' ' 440' ' ' TYR . 4.7 ppp? -81.11 25.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 24.1 m-85 -134.59 157.23 47.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.86 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.5 p -80.1 135.47 36.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -111.49 28.15 9.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.881 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.47 163.32 69.1 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.608 0.718 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 120.08 6.92 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.701 2.268 . . . . 0.0 112.318 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.523 HD21 HD11 ' A' ' 490' ' ' LEU . 30.3 mt -40.91 143.79 0.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 39.4 p -126.54 156.09 41.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -39.87 -34.1 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -76.74 -74.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.879 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 20.4 p -45.16 -50.44 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.465 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.03 -49.59 1.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -50.83 -45.31 59.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.472 HD21 ' CG ' ' A' ' 434' ' ' ARG . 93.8 mt -48.2 -64.1 0.89 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.523 HD11 HD21 ' A' ' 482' ' ' LEU . 97.1 mt -39.82 -53.75 2.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -46.13 -47.33 17.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.843 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -73.66 -57.74 3.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.86 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -46.4 -64.23 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.869 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 490' ' ' LEU . 10.5 mp -50.26 -53.94 24.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.953 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -49.44 -47.04 48.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.157 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -49.22 -50.12 39.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.835 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.88 -57.05 14.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.877 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -58.77 -66.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.113 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 498' ' ' ALA . 36.8 tt0 -31.36 -58.55 0.25 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.882 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -32.3 101.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.136 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 71.84 55.02 7.63 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.45 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -162.16 154.31 19.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 0.0 111.085 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -89.08 141.23 28.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.952 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -140.11 156.86 46.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.881 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -147.36 133.85 19.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -156.65 131.81 9.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.78 164.69 28.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 86.7 t -109.08 117.72 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.084 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.93 156.68 36.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -120.61 176.37 5.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.529 ' H ' HD23 ' A' ' 511' ' ' LEU . 1.7 pt? -124.69 43.64 2.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.452 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER 34.38 53.18 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -45.18 104.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 3.8 t -106.84 -47.67 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.838 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 89.65 162.77 38.7 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 158.17 57.82 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.688 2.259 . . . . 0.0 112.35 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 24.3 p -109.25 141.64 41.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.884 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 78.4 p -111.78 168.51 9.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 119.161 -0.799 . . . . 0.0 112.477 -179.979 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 44.1 t -90.24 130.61 36.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.854 0.359 . . . . 0.0 110.85 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 41.9 t -128.33 148.66 50.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -144.32 153.74 25.28 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.484 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 45.5 t -150.19 163.9 37.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.844 0.354 . . . . 0.0 110.899 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 2.8 m -147.84 161.46 41.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.88 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 132.31 163.0 10.54 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.506 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -70.95 102.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.874 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.797 ' O ' HD22 ' A' ' 430' ' ' LEU . 0.0 OUTLIER -67.35 143.66 97.49 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.65 0.738 . . . . 0.0 110.914 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 -92.15 0.01 OUTLIER 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.685 2.257 . . . . 0.0 112.323 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 432' ' ' LYS . . . . . 0.584 ' O ' HD23 ' A' ' 430' ' ' LEU . 48.1 mmtt -63.33 130.23 43.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.551 ' HE3' ' CE1' ' A' ' 453' ' ' TYR . 22.6 mtmt -92.21 14.43 16.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.907 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 38.14 50.33 1.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 435' ' ' GLU . . . . . 0.475 ' HB3' ' CD2' ' A' ' 453' ' ' TYR . 14.2 tt0 -138.07 145.05 41.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.918 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.411 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.6 tp -72.99 112.26 8.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.938 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 18.5 t -43.28 141.75 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.476 ' HG2' ' CD1' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -79.89 -5.64 55.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.91 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 439' ' ' PHE . . . . . 0.476 ' CD1' ' HG2' ' A' ' 438' ' ' LYS . 46.3 m-85 -110.17 -54.03 2.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -42.2 -23.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.9 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 439' ' ' PHE . 61.8 mt -50.53 -40.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.107 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 41.3 p -99.71 6.24 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.158 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 79.87 -9.61 44.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.464 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -99.85 100.88 11.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.369 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.3 t -131.41 122.96 27.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.5 -59.08 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.118 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 97.0 mtt180 -88.65 107.96 19.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.81 -77.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -82.59 25.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -132.87 0.85 3.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.928 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 6.9 t -78.89 111.73 21.96 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.66 0.743 . . . . 0.0 110.869 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 5.17 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.716 2.277 . . . . 0.0 112.291 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.551 ' CE1' ' HE3' ' A' ' 433' ' ' LYS . 20.7 m-85 -99.93 -176.27 3.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.967 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.2 mmm -95.43 134.61 38.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -117.19 -75.51 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.29 -62.15 2.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.477 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 10.0 m-20 -34.74 -50.69 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 0.0 110.823 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 436' ' ' LEU . 21.3 t80 -40.14 123.97 1.67 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 0.0 110.865 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 151.5 69.19 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.638 2.225 . . . . 0.0 112.322 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.543 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.8 t -73.95 145.96 44.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.404 ' O ' HG23 ' A' ' 465' ' ' THR . 29.6 tttt -78.76 -68.06 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.3 mt -44.25 -59.73 2.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.472 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 70.7 t80 -39.5 -25.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.924 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 30.2 m-70 -99.08 -52.93 3.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.429 ' C ' ' O ' ' A' ' 464' ' ' HIS . 53.1 p -34.75 -35.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.3 p -132.96 -37.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.472 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.34 -41.22 1.35 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.513 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.96 165.71 11.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.896 0.379 . . . . 0.0 110.87 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 47.5 t -117.9 150.16 39.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.9 tp -79.83 -34.85 15.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.154 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -53.54 -66.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 135.85 -171.08 22.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.445 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -35.02 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.818 0.342 . . . . 0.0 110.854 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -100.22 59.85 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 24.7 t -79.47 152.51 30.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.586 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 3.6 ppp? -68.73 -21.79 64.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.912 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.586 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.6 m-85 -105.51 159.41 15.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 27.3 m -79.12 140.38 37.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -104.24 24.34 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.16 154.6 60.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.6 0.714 . . . . 0.0 110.856 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 120.08 6.93 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.731 2.288 . . . . 0.0 112.347 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.517 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 41.1 mt -40.14 143.34 0.29 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 46.8 p -126.71 153.35 45.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.104 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 485' ' ' GLU . 4.3 pt-20 -40.26 -30.78 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.451 ' N ' ' HG3' ' A' ' 484' ' ' GLU . 11.5 tp10 -80.31 -73.64 0.35 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 60.2 p -45.0 -48.03 11.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.13 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.67 -42.27 1.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.832 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -61.31 -43.78 98.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.874 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 23.4 mt -45.03 -64.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.41 HD11 HD21 ' A' ' 482' ' ' LEU . 75.1 mt -39.87 -57.27 1.62 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.951 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.38 -43.58 1.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -79.0 -51.92 8.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.9 tmm? -53.69 -63.31 1.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 21.4 mt -44.3 -46.34 9.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -66.06 -41.22 91.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.069 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.2 -44.95 72.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -69.92 -63.59 1.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.846 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -44.01 -55.74 4.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.085 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.48 -44.79 69.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -79.84 46.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.118 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 93.52 151.83 28.52 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -164.12 109.68 1.03 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 111.086 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -144.45 155.94 43.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -157.9 163.18 38.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' GLU . . . . . 0.415 ' C ' ' HG3' ' A' ' 506' ' ' LYS . 0.6 OUTLIER -173.42 158.75 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 506' ' ' LYS . . . . . 0.415 ' HG3' ' C ' ' A' ' 505' ' ' GLU . 42.1 mtpt -150.63 176.13 11.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.9 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -163.48 144.37 9.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 91.4 t -125.53 103.47 11.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.9 mp0 -52.36 175.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -66.06 166.17 12.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 1.8 pp -146.47 129.43 16.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 51.32 36.55 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.94 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' LYS . . . . . 0.473 ' HG2' ' N ' ' A' ' 514' ' ' SER . 48.0 tttm -38.14 154.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.879 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.473 ' N ' ' HG2' ' A' ' 513' ' ' LYS . 3.9 t -46.45 166.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.864 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 171.98 74.21 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.522 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 -174.95 0.99 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.681 2.254 . . . . 0.0 112.391 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 94.8 p -163.68 169.26 18.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 56.1 m -144.45 178.04 8.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.881 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 CA-C-O 119.107 -0.829 . . . . 0.0 112.529 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.496 -0.241 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 43.1 t -139.42 109.45 6.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.907 0.384 . . . . 0.0 110.876 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 36.8 p -38.25 113.2 0.27 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 425' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 426' ' ' SER . . . 158.32 66.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.4 ' C ' ' O ' ' A' ' 425' ' ' GLY . 41.8 m -37.67 133.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.932 0.396 . . . . 0.0 110.848 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 38.7 m -102.33 115.08 29.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.854 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 142.79 51.25 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -120.51 124.48 45.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.857 0.36 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 22.0 mt -135.05 155.0 79.43 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.592 0.71 . . . . 0.0 110.894 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.83 89.98 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 0.0 112.359 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -139.65 179.82 6.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -131.08 96.53 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.02 54.19 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' GLU . . . . . 0.423 ' OE2' ' N ' ' A' ' 436' ' ' LEU . 0.8 OUTLIER -131.08 138.68 49.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.53 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 40.2 tp -57.91 114.42 2.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.8 t -47.72 138.42 8.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.92 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -77.02 -3.38 38.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -110.18 -51.06 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -43.15 -35.75 1.47 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.8 mt -39.89 -37.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 16.5 p -99.35 -36.01 9.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.162 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.08 11.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -97.19 88.88 4.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.875 0.369 . . . . 0.0 110.888 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 51.2 t -128.28 99.38 5.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.854 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -38.63 -61.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.108 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.448 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 61.9 mtt180 -77.31 105.18 8.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.58 -76.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 449' ' ' GLU . 32.2 tt0 -82.92 7.02 16.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -107.56 -12.03 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 18.4 t -68.63 111.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.587 0.708 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 4.47 2.19 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.672 2.248 . . . . 0.0 112.326 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -99.6 176.46 5.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.927 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 15.1 mmm -88.65 140.95 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.891 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -122.14 -74.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.505 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.39 -67.97 1.51 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.455 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.505 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.4 m-20 -29.94 -49.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.884 0.373 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.53 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.4 t80 -41.57 128.2 2.36 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.645 0.736 . . . . 0.0 110.884 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 150.01 67.59 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.67 2.247 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 52.8 t -72.23 142.29 48.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -76.83 -66.47 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 464' ' ' HIS . 33.0 mt -45.81 -57.76 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -42.48 -23.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.933 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.566 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 29.1 m-70 -99.02 -50.17 4.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.491 ' C ' ' O ' ' A' ' 464' ' ' HIS . 72.0 p -30.51 -47.84 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.118 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.9 p -127.23 -31.91 2.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.163 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.68 -34.05 2.46 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -110.46 145.33 37.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 0.0 110.902 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.0 t -106.36 118.64 37.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -50.26 -37.84 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -49.92 -50.45 46.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 106.4 -152.86 17.03 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.496 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -80.07 12.91 2.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 0.0 110.845 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -123.95 34.35 5.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 45.6 t -79.56 139.58 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.41 ' SD ' ' O ' ' A' ' 476' ' ' MET . 4.4 ppp? -81.1 22.46 0.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.401 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 16.0 m-85 -130.9 161.49 31.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.863 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.9 m -80.1 127.11 31.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.852 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -99.68 26.65 6.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.832 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' ASP . . . . . 0.41 ' HB2' ' HD2' ' A' ' 481' ' ' PRO . 3.1 p30 -69.68 154.86 94.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 481' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 480' ' ' ASP . 53.5 Cg_endo -69.76 120.55 7.32 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.714 2.276 . . . . 0.0 112.372 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.566 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 54.4 mt -39.79 132.06 1.76 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.423 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 69.4 p -109.45 172.24 6.97 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -49.7 -35.68 22.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' A' ' 486' ' ' THR . 9.4 tp10 -78.54 -75.33 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 485' ' ' GLU . 49.6 p -36.37 -52.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.134 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.6 OUTLIER -39.99 -47.12 2.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.09 -44.35 95.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 486' ' ' THR . 78.1 mt -48.85 -65.68 0.53 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 45.2 mt -40.08 -55.27 2.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -42.81 -41.67 3.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 492' ' ' LYS . 7.2 tmtm? -76.9 -53.26 8.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -50.87 -58.96 4.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.847 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 64.5 mt -56.65 -55.5 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.87 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.51 -60.18 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.07 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -41.4 -42.52 2.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.873 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -74.56 -67.39 0.63 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -38.22 -44.05 0.83 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 500' ' ' ALA . 20.4 tt0 -68.2 -55.33 12.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.894 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -37.92 -59.1 0.87 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.056 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -164.86 130.58 2.2 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.468 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -91.04 154.74 19.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.762 0.315 . . . . 0.0 111.066 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' GLU . . . . . 0.465 ' HG2' ' N ' ' A' ' 504' ' ' ASP . 17.2 tt0 -164.5 151.47 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' ASP . . . . . 0.465 ' N ' ' HG2' ' A' ' 503' ' ' GLU . 6.6 m-20 61.47 45.23 8.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -103.39 40.33 1.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -157.18 141.03 16.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.857 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 507' ' ' GLU . 0.6 OUTLIER -85.05 125.11 32.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 87.5 t -74.24 81.66 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -96.23 95.19 7.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.26 150.22 14.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 24.1 mt -52.95 -173.18 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 49.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.5 125.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.905 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 4.2 m -162.12 163.77 28.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -160.61 136.9 4.71 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.495 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 -174.86 1.0 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.649 2.233 . . . . 0.0 112.35 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.3 t -124.66 146.66 48.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.817 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 3.6 t -114.79 163.97 14.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.905 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 119.151 -0.805 . . . . 0.0 112.434 -179.996 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 11.6 t -161.51 130.82 4.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 0.0 110.836 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 90.4 p -153.15 137.34 16.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.892 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 133.96 77.22 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 14.5 t -145.36 108.34 4.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.852 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 58.6 p -80.5 75.16 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.793 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -91.67 36.56 3.61 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.526 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -161.05 146.17 14.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 40.7 mt -119.76 157.43 52.32 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 0.0 110.901 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 2.41 3.58 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.656 2.237 . . . . 0.0 112.354 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp -106.48 114.0 27.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.849 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 63.1 mttt -86.52 111.89 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -79.05 48.31 0.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.862 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -121.64 152.39 39.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 40.5 tp -67.52 124.0 22.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.935 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 17.1 t -57.26 127.6 32.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.04 -3.38 16.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -107.62 -44.06 4.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.45 ' CD2' ' CG ' ' A' ' 455' ' ' HIS . 30.4 t80 -51.65 -38.57 55.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.902 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.7 mt -39.58 -35.38 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.119 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.97 -31.27 11.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.133 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 112.89 -4.22 25.79 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.479 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 444' ' ' PHE . . . . . 0.451 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -100.33 85.91 3.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.875 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 48.6 t -121.27 102.54 8.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.867 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.14 -69.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.8 mtt85 -76.9 104.65 7.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.909 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.94 -74.55 0.32 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -81.93 21.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.944 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -128.82 -4.28 5.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 32.8 t -70.66 111.74 10.68 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.632 0.729 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 2.39 3.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 44.4 m-85 -100.99 177.14 5.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 37.8 mmm -90.97 142.54 27.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.45 ' CG ' ' CD2' ' A' ' 440' ' ' TYR . 18.5 m170 -120.36 -75.77 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.46 -64.84 1.79 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.457 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -32.29 -47.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 21.6 t80 -46.16 122.59 6.43 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.727 . . . . 0.0 110.864 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 143.86 51.8 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.325 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.6 t -65.7 135.56 55.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 465' ' ' THR . 6.5 ttpt -73.44 -64.96 0.88 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 464' ' ' HIS . 44.3 mt -44.44 -58.31 3.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.401 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 28.0 t80 -39.11 -25.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' A' ' 462' ' ' LEU . 64.3 m-70 -100.67 -55.33 2.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.822 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 461' ' ' LYS . 30.2 p -32.98 -39.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.2 p -128.58 -38.29 1.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.401 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 138.27 -38.26 1.71 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.523 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -111.01 155.42 22.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.856 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 23.9 t -106.52 136.09 46.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.404 HG22 HD13 ' A' ' 462' ' ' LEU . 6.1 tp -76.07 -25.97 17.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -56.33 -39.38 72.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 109.75 -161.11 13.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.516 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.8 -13.75 59.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.832 0.349 . . . . 0.0 110.935 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -99.98 29.62 4.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -71.96 131.37 42.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.491 ' C ' ' SD ' ' A' ' 476' ' ' MET . 0.0 OUTLIER -81.25 34.04 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.449 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 10.7 m-85 -132.92 155.12 49.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.922 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.7 m -80.18 127.91 32.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -99.76 15.67 26.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.31 156.23 61.92 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.597 0.713 . . . . 0.0 110.864 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 119.71 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.615 2.21 . . . . 0.0 112.35 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.525 HD11 ' CD1' ' A' ' 490' ' ' LEU . 29.0 mt -39.87 147.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 82.1 p -126.27 157.86 37.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.095 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -41.91 -33.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -80.96 -76.4 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 489' ' ' LEU . 59.6 p -44.92 -48.99 11.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.165 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -38.86 -45.16 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -56.22 -41.31 75.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 486' ' ' THR . 51.9 mt -45.88 -62.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.525 ' CD1' HD11 ' A' ' 482' ' ' LEU . 81.8 mt -41.74 -56.55 2.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.958 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -42.72 -41.99 3.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -80.2 -60.01 2.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' MET . . . . . 0.511 ' CE ' HD12 ' A' ' 494' ' ' LEU . 13.4 tmm? -41.6 -57.4 2.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.895 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 494' ' ' LEU . . . . . 0.511 HD12 ' CE ' ' A' ' 493' ' ' MET . 10.4 mp -56.14 -49.27 74.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.933 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -43.41 -53.24 5.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.083 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -55.61 -40.77 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 500' ' ' ALA . 22.6 t0 -67.72 -59.29 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.853 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -53.51 -45.97 69.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.103 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -83.99 19.12 1.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 497' ' ' ASP . . . -68.34 91.77 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.081 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 501' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . -71.28 70.41 0.83 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.483 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 502' ' ' ALA . . . . . 0.45 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . 33.67 42.34 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.759 0.314 . . . . 0.0 111.04 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 -45.83 152.34 0.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.891 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -98.69 121.9 41.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -142.44 129.97 21.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.92 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 16.5 mtmm -163.11 154.26 17.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -120.77 179.55 4.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.1 p -105.39 129.43 58.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -90.46 171.42 9.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -110.35 134.79 51.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.877 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.93 44.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.911 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 513' ' ' LYS . 17.5 tttm 40.23 40.58 0.83 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.914 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 513' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 512' ' ' LYS . 9.4 tmtt? -36.97 122.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 75.8 m -136.68 155.07 50.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.866 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -152.09 90.96 0.13 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.522 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 179.31 3.79 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 0.0 112.325 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 15.4 m -145.94 155.91 43.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 38.5 m -145.21 167.3 23.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.135 -0.814 . . . . 0.0 112.495 -179.976 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 70.9 m 63.5 42.15 6.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 92.0 p -79.92 148.92 31.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -98.57 -151.51 27.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.506 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 99.7 p -159.9 172.1 18.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 0.0 110.885 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 55.3 p -101.34 153.16 19.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.836 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 428' ' ' GLY . . . . . 0.514 ' O ' HD12 ' A' ' 430' ' ' LEU . . . -115.29 44.9 1.39 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.462 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.07 130.52 47.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.909 0.385 . . . . 0.0 110.832 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 428' ' ' GLY . 7.2 mp -97.56 157.85 34.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.62 0.724 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 3.06 3.02 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.657 2.238 . . . . 0.0 112.287 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -87.26 139.36 30.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 18.5 mttp -113.93 149.88 34.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.907 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -118.88 44.77 2.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -120.16 154.48 34.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.897 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 35.6 tp -70.86 129.02 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.4 t -66.0 131.63 46.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.919 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.42 2.53 9.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.933 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -114.95 -47.46 2.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -48.17 -35.2 11.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.9 mt -41.12 -33.85 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.168 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 66.6 p -99.74 -33.33 10.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.09 -9.08 13.95 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.15 98.57 9.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.378 . . . . 0.0 110.834 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.6 t -134.5 111.56 10.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.04 -62.08 0.78 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 45.6 mtt180 -85.28 111.07 19.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.93 -79.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.086 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.06 0.99 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -102.17 -5.07 24.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 9.7 t -70.38 111.92 11.07 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.59 0.71 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.659 2.239 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.524 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -100.29 -176.17 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.93 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 21.2 mmm -97.36 138.75 34.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.5 m170 -119.82 -75.39 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.43 -62.26 2.09 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.455 ' C ' ' O ' ' A' ' 456' ' ' GLY . 68.9 m-20 -34.18 -50.92 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 110.875 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -40.84 127.96 1.94 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.679 0.752 . . . . 0.0 110.886 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 140.42 42.69 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.681 2.254 . . . . 0.0 112.354 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 13.7 t -59.13 144.28 46.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.902 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 56.1 tttp -77.97 -68.84 0.59 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.86 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.579 HD13 HG22 ' A' ' 470' ' ' ILE . 29.8 mt -45.15 -58.09 3.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.448 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 54.9 t80 -40.25 -24.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.897 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.55 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.5 m-70 -100.17 -52.42 3.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.433 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.6 p -33.44 -41.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.149 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 38.1 p -128.37 -29.22 2.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.448 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 128.75 -38.74 1.99 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.439 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -109.83 149.08 30.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.851 0.358 . . . . 0.0 110.885 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.1 t -102.22 131.43 48.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.898 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.579 HG22 HD13 ' A' ' 462' ' ' LEU . 8.5 tp -77.73 -21.94 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.143 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -50.63 -48.25 58.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 132.14 -168.97 22.33 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.508 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.94 -33.81 72.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.842 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.02 64.06 0.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.0 t -73.58 153.35 40.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.895 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.535 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.9 ppp? -75.61 -20.03 58.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.535 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 18.0 m-85 -104.26 161.17 14.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.867 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 68.5 m -79.97 151.27 30.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 48.6 m170 -115.04 30.2 7.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.91 157.86 85.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.586 0.708 . . . . 0.0 110.906 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 131.27 20.8 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.713 2.275 . . . . 0.0 112.306 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.55 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 38.6 mt -56.15 149.38 16.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 485' ' ' GLU . 66.4 p -136.35 154.97 50.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.132 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.79 -29.7 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.4 mt-10 -78.94 -74.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.913 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.3 p -48.6 -50.64 31.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.108 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -48.53 2.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.852 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -52.52 -40.77 62.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 77.2 mt -53.26 -61.25 2.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.872 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 94.9 mt -41.87 -56.65 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -41.95 -40.61 2.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.871 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.09 -57.18 3.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.894 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.7 tmm? -48.96 -60.56 2.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 96.6 mt -40.97 -44.95 2.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.19 96.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.099 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -50.96 -41.68 59.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.849 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -85.99 -55.45 3.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -43.01 -55.91 3.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.087 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -48.57 -52.07 24.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -58.06 -60.5 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.08 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . 117.79 76.79 0.57 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 502' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . -35.36 102.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.748 0.309 . . . . 0.0 111.11 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -69.87 99.42 1.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -87.75 97.41 10.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -109.29 161.36 15.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -140.54 125.01 17.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.872 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -82.25 149.47 27.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 508' ' ' VAL . 8.8 p -112.86 124.15 69.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -112.29 143.35 43.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -51.87 159.36 0.85 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 512' ' ' LYS . 2.0 pt? -134.77 -35.8 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.441 ' N ' ' HG ' ' A' ' 511' ' ' LEU . 7.8 ttpt -101.19 41.22 1.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -81.1 95.43 6.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 5.3 t -127.91 165.38 20.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.84 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.19 14.67 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.482 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -175.58 1.2 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.682 2.255 . . . . 0.0 112.317 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 46.1 m -145.69 154.04 41.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.841 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 19.6 m -158.24 153.77 26.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 CA-C-O 119.102 -0.832 . . . . 0.0 112.516 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 64.4 m -109.08 110.6 21.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 88.7 p -110.01 165.52 11.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.843 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 124.77 107.1 1.68 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.464 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 2.3 m -136.13 110.92 8.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.895 0.379 . . . . 0.0 110.838 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 90.4 p -99.53 109.54 22.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.856 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -148.25 96.36 0.17 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.43 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -79.38 166.3 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.92 0.39 . . . . 0.0 110.873 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.9 mp -128.42 159.51 67.2 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.601 0.715 . . . . 0.0 110.926 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 3.24 2.9 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.693 2.262 . . . . 0.0 112.339 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp -93.46 144.34 25.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 11.3 mttp -105.24 148.75 26.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.583 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.7 mpt_? -121.59 42.98 2.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -116.58 151.4 36.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 37.3 tp -58.73 125.99 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.874 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 14.7 t -65.06 146.25 55.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -79.91 -10.64 59.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.88 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -104.1 -46.14 4.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 455' ' ' HIS . 21.9 t80 -47.43 -36.33 9.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.889 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.1 mt -42.95 -37.68 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.114 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 70.8 p -101.6 -36.69 8.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.138 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.46 -4.76 17.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 444' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 10.6 t80 -99.63 71.33 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 110.853 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.77 105.31 15.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -61.27 0.88 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.104 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -83.44 109.48 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.871 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.74 -78.58 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.125 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -81.34 -1.21 44.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -99.4 0.07 41.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 10.3 t -80.08 111.11 19.31 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.627 0.727 . . . . 0.0 110.885 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.7 Cg_endo -69.8 3.83 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.7 2.267 . . . . 0.0 112.336 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -99.87 179.99 4.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.0 mmm -95.16 140.54 29.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.823 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 440' ' ' TYR . 18.8 m170 -119.19 -76.11 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.37 -65.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.464 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.451 ' C ' ' O ' ' A' ' 456' ' ' GLY . 29.0 m-20 -33.93 -43.69 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.862 0.363 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 18.6 t80 -43.19 128.48 3.46 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.598 0.713 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 149.25 66.7 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.645 2.23 . . . . 0.0 112.399 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.467 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 9.2 t -74.28 150.3 40.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.89 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 465' ' ' THR . 16.3 ttmt -80.75 -69.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.1 mt -43.77 -60.3 1.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 463' ' ' TYR . . . . . 0.412 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 86.3 t80 -39.29 -25.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 13.6 m-70 -99.48 -51.67 3.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 464' ' ' HIS . 54.2 p -33.78 -38.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.0 p -131.29 -36.71 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.156 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' GLY . . . . . 0.412 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 140.3 -39.07 1.52 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.483 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 468' ' ' ASN . . . . . 0.438 ' CG ' ' N ' ' A' ' 469' ' ' CYS . 21.2 t-20 -107.79 168.18 9.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 469' ' ' CYS . . . . . 0.438 ' N ' ' CG ' ' A' ' 468' ' ' ASN . 17.7 t -120.9 150.3 41.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.3 tp -76.02 -36.49 31.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.112 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -52.6 -61.79 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 138.61 -156.64 24.26 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.99 -39.63 87.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.755 0.312 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.67 63.71 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -79.06 144.47 34.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.89 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 3.9 ppp? -55.71 -24.2 33.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.875 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 33.5 m-85 -104.28 160.14 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.884 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.4 m -80.04 145.87 32.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.898 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -111.55 22.58 14.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' ASP . . . . . 0.407 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 71.1 m-20 -58.41 156.35 22.81 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.627 0.727 . . . . 0.0 110.83 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 481' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.4 Cg_endo -69.74 112.1 2.99 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.716 2.278 . . . . 0.0 112.358 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 18.2 mt -39.72 129.37 2.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.93 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 7.2 p -102.63 -179.94 4.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.11 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 484' ' ' GLU . . . . . 0.431 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 0.2 OUTLIER -70.41 -30.83 67.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.431 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 12.7 pt-20 -79.0 -42.33 26.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.917 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.9 p -68.57 -50.85 48.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.132 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.0 OUTLIER -39.38 -31.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.12 -41.38 74.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 434' ' ' ARG . 49.9 mt -53.56 -66.06 0.46 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 91.8 mt -39.93 -56.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -39.69 -41.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 496' ' ' ASP . 1.7 tppp? -80.09 -42.76 22.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -59.6 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 58.7 mt -49.1 -56.47 9.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.27 71.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' ASP . . . . . 0.4 ' CG ' ' O ' ' A' ' 492' ' ' LYS . 64.1 m-20 -43.68 -48.92 7.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.401 ' O ' ' C ' ' A' ' 498' ' ' ALA . 6.0 t70 -78.71 -61.93 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.865 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.401 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -36.3 -50.48 0.75 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -46.04 -57.74 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.46 -54.71 16.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.113 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.17 -122.6 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.491 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -168.1 130.33 1.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 111.128 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -120.44 105.75 11.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -98.31 174.43 6.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -132.98 176.39 8.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -158.1 133.64 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.908 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -146.77 109.43 4.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.84 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -75.79 92.24 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.168 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.48 149.9 7.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -75.81 174.2 10.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.696 ' H ' HD23 ' A' ' 511' ' ' LEU . 1.8 pt? -116.75 42.08 2.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 511' ' ' LEU . 50.2 mttt 35.22 42.07 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.915 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 512' ' ' LYS . 7.5 ttpt -35.53 140.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.935 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 70.0 m -146.18 170.64 16.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -141.29 130.33 4.4 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.488 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -48.51 0.71 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.702 2.268 . . . . 0.0 112.322 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.2 t 55.65 41.29 30.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.849 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.3 t -92.7 169.28 10.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.843 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 CA-C-O 119.147 -0.807 . . . . 0.0 112.464 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.455 -0.258 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 27.5 m -127.09 109.89 12.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.914 0.388 . . . . 0.0 110.854 -179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 1.9 t -42.26 153.79 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 120.41 121.6 2.89 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 1.1 t 56.97 41.06 28.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.908 0.385 . . . . 0.0 110.872 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 38.8 m -90.29 174.63 7.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.837 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 156.34 164.59 13.55 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.503 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -119.59 177.43 4.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 73.9 mt -138.14 144.36 43.09 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.595 0.712 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -168.23 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.714 2.276 . . . . 0.0 112.331 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 16.1 mmtm 52.85 25.24 3.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.93 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 452' ' ' PRO . 56.2 mttt -38.37 132.54 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.668 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.8 tpp85 -89.15 63.75 6.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -139.17 144.08 38.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.854 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 35.6 tp -61.95 132.5 53.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 437' ' ' CYS . . . . . 0.446 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 7.0 t -67.06 137.79 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -77.48 -7.28 55.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.91 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -109.54 -44.12 3.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.46 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 39.2 t80 -48.13 -34.66 10.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.905 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 63.5 mt -43.48 -32.9 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.129 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 p -99.51 -33.8 10.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.139 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.01 -10.58 13.58 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.501 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -100.43 98.99 9.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.865 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 37.6 t -136.42 109.47 7.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.51 -59.31 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 7.8 mtm105 -80.49 107.16 13.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.18 -77.61 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -82.43 -10.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -99.45 15.61 25.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.891 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 35.8 t -80.42 111.72 25.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.1 Cg_endo -69.75 3.21 2.9 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.64 2.227 . . . . 0.0 112.368 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -105.35 -175.11 2.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 40.3 mmm -100.74 136.52 40.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.899 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.46 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 24.8 m170 -118.13 -75.24 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.74 -65.3 1.78 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.516 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 456' ' ' GLY . 8.3 m-20 -33.44 -47.26 0.21 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.826 0.346 . . . . 0.0 110.847 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 17.2 t80 -43.46 130.3 3.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.64 0.734 . . . . 0.0 110.845 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 146.25 59.34 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.685 2.257 . . . . 0.0 112.345 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.533 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 45.4 t -70.19 146.14 50.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.885 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -79.64 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 464' ' ' HIS . 35.2 mt -45.41 -59.77 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.958 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -40.91 -22.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 28.5 m-70 -100.19 -54.96 2.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.47 ' C ' ' O ' ' A' ' 464' ' ' HIS . 71.8 p -31.17 -41.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.136 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.408 ' N ' ' O ' ' A' ' 464' ' ' HIS . 77.8 p -128.75 -36.78 1.8 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.114 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 137.9 -38.07 1.75 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.476 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -106.72 174.32 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.866 0.365 . . . . 0.0 110.852 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.8 t -133.17 128.7 36.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.4 tp -72.11 -26.63 25.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -49.59 -43.52 46.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.15 -169.59 23.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.6 -29.48 51.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.773 0.321 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -100.67 44.33 1.02 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 47.7 t -51.17 144.27 9.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.513 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 5.1 ppp? -65.42 -17.35 64.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.513 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 17.8 m-85 -102.81 159.44 15.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 29.1 m -80.13 132.41 35.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -100.8 23.5 10.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.77 159.51 52.94 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.612 0.72 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 110.79 2.65 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.671 2.247 . . . . 0.0 112.332 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.48 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 24.9 mt -40.16 131.5 2.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 483' ' ' THR . . . . . 0.564 ' OG1' HG23 ' A' ' 486' ' ' THR . 24.8 p -99.59 169.63 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.14 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -56.2 -30.98 63.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -81.41 -55.47 4.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.575 ' HA ' HD12 ' A' ' 489' ' ' LEU . 47.6 p -55.32 -37.95 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.119 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 487' ' ' ARG . 0.0 OUTLIER -52.3 -41.84 63.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -65.28 -33.39 75.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.668 HD22 ' O ' ' A' ' 434' ' ' ARG . 62.9 mt -59.39 -65.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 493' ' ' MET . 40.6 mt -40.13 -61.57 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -39.95 -41.91 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -79.94 -31.02 40.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' MET . . . . . 0.467 ' N ' ' O ' ' A' ' 490' ' ' LEU . 14.0 tmm? -63.32 -59.4 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.4 mp -43.23 -46.69 6.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.886 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -68.8 -53.32 22.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.136 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' ASP . . . . . 0.401 ' HA ' ' CG ' ' A' ' 499' ' ' GLU . 0.8 OUTLIER -49.43 -38.35 29.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.884 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.51 -55.57 19.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' ALA . . . . . 0.475 ' O ' ' N ' ' A' ' 500' ' ' ALA . . . -66.57 -64.3 0.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 499' ' ' GLU . . . . . 0.568 ' OE2' ' HB2' ' A' ' 500' ' ' ALA . 1.6 pp20? -35.97 -31.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.568 ' HB2' ' OE2' ' A' ' 499' ' ' GLU . . . -85.3 47.56 1.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.124 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 501' ' ' GLY . . . . . 0.44 ' C ' ' O ' ' A' ' 500' ' ' ALA . . . 34.41 89.58 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.504 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -51.0 114.3 1.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.82 0.343 . . . . 0.0 111.111 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.4 172.0 7.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.826 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -122.94 167.02 14.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.863 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -143.21 163.4 33.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.879 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -147.64 168.12 22.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.861 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -162.11 149.77 14.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 86.6 t -129.84 125.06 60.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.115 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -83.26 167.58 17.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.896 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 512' ' ' LYS . 0.2 OUTLIER -100.76 157.05 16.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.927 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.817 HD12 ' O ' ' A' ' 511' ' ' LEU . 3.6 pp -103.2 50.3 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.426 ' H ' ' CD ' ' A' ' 510' ' ' GLU . 41.9 tttm 40.2 46.58 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.85 116.94 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.909 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 13.7 t -174.95 148.97 1.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.863 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -119.1 113.98 2.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.474 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 171.0 15.25 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.722 2.281 . . . . 0.0 112.333 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 4.6 m -156.64 176.54 12.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' SER . . . . . 0.437 ' O ' ' C ' ' A' ' 519' ' ' GLY . 17.6 m 61.4 42.45 11.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.892 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 519' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 518' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.097 -0.835 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 23.1 t -62.89 155.28 27.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 90.6 p -95.35 147.34 23.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.879 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -91.56 147.64 18.9 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.507 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 6.2 t -114.69 114.86 26.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.852 0.358 . . . . 0.0 110.868 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 1.7 m -136.55 121.77 19.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -115.44 177.24 17.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.421 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 430' ' ' LEU . 61.3 mm-40 -113.34 153.1 29.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 110.9 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' A' ' 429' ' ' GLU . 53.6 mt -35.33 153.37 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.629 0.728 . . . . 0.0 110.904 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.73 75.74 1.18 Allowed 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.721 2.281 . . . . 0.0 112.36 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 42.0 mmtt -152.63 -179.14 7.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -135.8 101.57 4.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.943 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 434' ' ' ARG . . . . . 0.476 ' HB2' ' CD2' ' A' ' 489' ' ' LEU . 0.0 OUTLIER -83.08 35.12 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -115.37 154.59 28.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' LEU . . . . . 0.502 HD13 ' CD2' ' A' ' 458' ' ' PHE . 52.4 tp -65.04 117.78 8.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.921 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 437' ' ' CYS . . . . . 0.468 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.1 t -50.66 116.99 2.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -60.23 -11.51 6.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -100.54 -48.68 4.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.49 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 42.3 t80 -47.09 -36.55 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 64.6 mt -40.05 -35.31 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.157 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 20.2 p -100.4 -33.45 10.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.56 -8.68 15.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.508 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.01 94.1 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 4.5 t -132.68 106.91 8.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.21 -67.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 25.0 mtm-85 -67.07 101.62 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.51 -75.11 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.072 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -81.34 -6.62 59.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -112.6 23.54 13.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.0 t -73.95 114.77 35.93 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.609 0.719 . . . . 0.0 110.925 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -5.92 17.36 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.68 2.254 . . . . 0.0 112.358 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -106.59 -173.54 2.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.1 mmm -99.63 148.55 24.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.916 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' HIS . . . . . 0.49 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 23.9 m170 -126.3 -76.68 0.58 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.837 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' N ' ' A' ' 458' ' ' PHE . . . -80.91 -65.28 1.72 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.475 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.2 m-20 -33.98 -35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 458' ' ' PHE . . . . . 0.502 ' CD2' HD13 ' A' ' 436' ' ' LEU . 16.3 t80 -56.79 124.9 66.57 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.665 0.745 . . . . 0.0 110.836 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 135.08 29.66 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 2.271 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 7.4 t -57.68 147.74 26.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.837 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -80.27 -68.16 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 464' ' ' HIS . 25.6 mt -45.52 -58.19 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.929 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -41.22 -23.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.557 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.4 m-70 -99.91 -51.41 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 80.8 p -33.11 -48.14 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 50.5 p -123.36 -32.32 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.167 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.22 -38.57 1.84 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.479 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -105.58 156.96 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.889 0.376 . . . . 0.0 110.873 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 11.4 t -117.3 130.82 56.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.872 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.8 tp -57.21 -29.3 31.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.143 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -56.75 -63.53 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.23 -148.26 19.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.501 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -76.31 -38.44 56.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.803 0.335 . . . . 0.0 110.827 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -100.4 63.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 51.9 t -78.86 147.61 33.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.4 ppp? -59.43 -23.59 62.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 25.0 m-85 -103.53 161.29 14.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 59.2 m -80.24 141.07 35.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.833 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 47.3 m170 -108.89 29.34 7.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.34 152.86 93.78 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.642 0.734 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.81 116.37 4.53 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 0.0 112.33 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.557 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 40.2 mt -40.06 147.54 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.2 p -129.74 155.46 45.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.11 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 3.5 pm0 -39.38 -31.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 485' ' ' GLU . . . . . 0.401 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 6.0 tm-20 -80.36 -73.99 0.33 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.689 ' HA ' HD12 ' A' ' 489' ' ' LEU . 15.7 p -47.61 -49.61 26.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.151 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -43.5 1.39 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -59.71 -41.82 91.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 486' ' ' THR . 31.5 mt -51.08 -64.79 0.7 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 490' ' ' LEU . . . . . 0.515 ' CD1' HD21 ' A' ' 482' ' ' LEU . 44.6 mt -40.62 -59.45 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -39.08 -37.31 0.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -38.91 30.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.925 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 493' ' ' MET . . . . . 0.437 ' N ' ' O ' ' A' ' 490' ' ' LEU . 12.1 tmm? -62.8 -58.75 6.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.825 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -46.99 -54.69 9.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.92 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.67 -40.68 95.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.115 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -59.59 -62.28 1.99 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.841 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -59.1 -60.22 4.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -39.61 -53.44 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.071 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.39 -60.99 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.907 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -78.58 89.28 4.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -102.23 -178.35 27.56 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.506 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -65.58 167.58 8.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 71.36 42.26 0.7 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.934 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -134.97 156.13 49.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -125.67 149.75 48.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -125.13 121.45 34.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -164.93 105.39 0.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.86 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.55 HG13 ' O ' ' A' ' 508' ' ' VAL . 10.3 p -104.77 114.35 44.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.106 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -65.53 132.93 50.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.903 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -91.46 36.37 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.522 ' O ' ' C ' ' A' ' 512' ' ' LYS . 13.3 mt 43.54 51.76 6.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 512' ' ' LYS . . . . . 0.522 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER 28.15 43.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.887 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 513' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 511' ' ' LEU . 4.7 tppp? -37.39 123.61 0.96 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 5.2 t -169.64 165.38 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.851 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 167.26 95.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.494 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 168.61 21.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.664 2.243 . . . . 0.0 112.367 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 54.1 p -162.34 143.57 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.89 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.5 t -167.58 164.61 14.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.873 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 CA-C-O 119.178 -0.79 . . . . 0.0 112.488 -179.998 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.462 -0.255 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 423' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 424' ' ' SER . 23.0 t -170.96 140.12 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.876 0.37 . . . . 0.0 110.842 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 424' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 423' ' ' SER . 23.3 t -36.91 151.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.853 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 75.19 -142.16 28.98 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.514 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 81.2 p -130.72 159.57 36.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 110.826 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 61.0 p -54.35 173.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -117.54 170.68 13.62 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.444 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -88.56 104.03 16.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.881 0.372 . . . . 0.0 110.903 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 430' ' ' LEU . . . . . 0.41 HD12 ' H ' ' A' ' 430' ' ' LEU . 0.3 OUTLIER -103.5 164.66 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.603 0.716 . . . . 0.0 110.89 -179.953 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 431' ' ' PRO . . . . . 0.407 ' HD2' ' HB2' ' A' ' 430' ' ' LEU . 53.4 Cg_endo -69.77 79.79 0.92 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.665 2.244 . . . . 0.0 112.323 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 35.3 mmtt -154.16 152.03 29.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 433' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 17.0 mttm -122.34 135.56 54.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.885 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 38.5 mmm-85 -109.17 39.49 2.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -112.25 151.09 30.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.77 124.12 20.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 37.8 t -67.75 139.47 56.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.455 ' HA ' HD12 ' A' ' 441' ' ' ILE . 2.7 mtmp? -79.57 4.75 14.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -109.12 -53.61 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.878 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 440' ' ' TYR . . . . . 0.463 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 22.1 t80 -46.89 -39.99 13.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 441' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 438' ' ' LYS . 53.4 mt -40.54 -37.98 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.097 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.7 p -101.7 -35.94 8.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.156 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.02 -9.96 13.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -99.06 87.62 3.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.892 0.377 . . . . 0.0 110.886 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.4 t -125.01 103.6 8.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.71 -59.08 1.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.174 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.7 mtt180 -81.98 107.52 14.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -79.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -82.6 8.5 11.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -108.34 -12.67 15.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 14.6 t -65.77 111.26 5.92 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.615 0.722 . . . . 0.0 110.893 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 452' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.6 Cg_endo -69.79 2.99 3.05 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.64 2.227 . . . . 0.0 112.342 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 453' ' ' TYR . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 80.3 m-85 -100.1 176.1 5.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 32.1 mmm -91.86 140.66 29.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.866 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -117.81 -77.25 0.57 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.464 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.84 -66.98 1.58 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' A' ' 456' ' ' GLY . 25.2 m-20 -32.58 -43.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.52 130.31 6.33 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.626 0.727 . . . . 0.0 110.85 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 144.3 53.79 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 0.0 112.322 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' CYS . . . . . 0.492 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 20.1 t -65.71 141.95 58.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 461' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 465' ' ' THR . 72.3 tttt -75.91 -66.74 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 462' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.0 mt -44.67 -58.64 2.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -39.37 -25.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' HIS . . . . . 0.54 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 48.2 m-70 -100.58 -53.14 3.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 465' ' ' THR . . . . . 0.474 ' C ' ' O ' ' A' ' 464' ' ' HIS . 56.0 p -31.38 -42.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.149 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 46.5 p -129.49 -32.92 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.149 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.95 -41.35 1.5 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.49 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -103.72 150.47 24.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.922 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 469' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 471' ' ' ASN . 53.3 t -110.69 99.9 8.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.87 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' ILE . . . . . 0.66 HG23 ' O ' ' A' ' 470' ' ' ILE . 8.1 tp -80.51 38.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 471' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 469' ' ' CYS . 30.2 m-20 -95.76 -54.73 3.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 170.11 154.32 9.3 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -47.42 -47.54 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.819 0.342 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -100.92 55.53 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -42.06 152.51 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' MET . . . . . 0.473 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 4.2 ppp? -77.31 -18.39 57.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.855 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.473 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.7 m-85 -105.72 158.93 16.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.862 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 67.5 m -80.1 144.81 32.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.852 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -108.12 31.87 5.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.75 158.07 81.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.602 0.715 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 134.49 28.12 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.688 2.259 . . . . 0.0 112.377 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.54 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 44.7 mt -62.13 137.03 58.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 69.1 p -119.9 152.55 37.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.125 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -40.03 -29.23 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.71 -75.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.838 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.45 ' O ' ' N ' ' A' ' 489' ' ' LEU . 48.6 p -46.9 -47.96 21.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.116 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 487' ' ' ARG . . . . . 0.412 ' HD3' HD13 ' A' ' 482' ' ' LEU . 4.4 tpt180 -40.34 -41.09 1.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -64.18 -39.27 93.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.946 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 486' ' ' THR . 79.1 mt -48.08 -67.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.87 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 60.7 mt -41.26 -57.18 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -39.96 -42.44 1.36 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.88 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -79.79 -44.61 20.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.882 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.4 tmm? -54.89 -59.29 4.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.869 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.9 mp -50.64 -60.83 2.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -43.88 -42.51 5.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -69.22 -59.61 2.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' A' ' 500' ' ' ALA . 9.6 m-20 -57.99 -64.46 0.9 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -38.14 -64.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.103 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.83 -42.91 80.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -114.03 99.27 7.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.056 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 501' ' ' GLY . . . . . 0.43 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . 141.72 -74.99 0.34 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.463 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 502' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . -35.7 115.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.756 0.313 . . . . 0.0 111.083 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -81.49 44.98 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 40.78 40.46 0.97 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.2 134.38 42.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.2 148.94 29.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.89 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -39.86 138.39 0.79 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.85 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 508' ' ' VAL . 8.1 p -122.83 34.55 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.132 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -172.82 173.65 3.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -81.81 112.64 19.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.895 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 511' ' ' LEU . 4.1 pp -81.2 41.52 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.951 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 29.5 mtmt 61.13 42.52 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -32.39 34.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 4.5 t -100.89 102.12 13.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.846 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -170.23 -100.82 0.14 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.474 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 151.95 69.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.721 2.281 . . . . 0.0 112.34 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 24.9 p -59.6 126.76 28.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.876 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 3.5 m -57.03 117.09 3.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.856 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 CA-C-O 119.181 -0.788 . . . . 0.0 112.484 -179.971 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 18.4 mmtp . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.779 0.323 . . . . 0.0 110.897 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.403 ' O ' HD22 ' A' ' 489' ' ' LEU . 0.0 OUTLIER -100.15 43.01 1.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.86 -180.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 436' ' ' LEU . 51.3 tp10 -114.52 162.54 16.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.916 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.454 ' N ' ' HG3' ' A' ' 435' ' ' GLU . 26.4 tp -74.65 104.72 5.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 34.9 t -42.41 135.3 2.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.477 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -71.1 -5.6 32.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.925 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -105.48 -49.4 3.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.555 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 40.6 t80 -43.27 -35.42 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -44.11 -39.1 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 58.6 p -100.32 -37.78 8.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.04 -4.52 18.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . 0.476 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -99.54 77.65 2.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.23 107.37 15.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.888 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.41 -59.0 1.41 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.102 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -84.77 111.12 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.14 -76.85 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.062 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -81.56 -5.21 57.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -99.4 6.83 45.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.869 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 44.8 t -80.09 111.41 21.79 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 1.5 4.34 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.692 2.261 . . . . 0.0 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -102.05 179.6 4.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 18.9 mmm -95.48 143.32 26.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.93 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.555 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 21.9 m170 -120.51 -77.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.18 -63.2 1.9 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.52 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.8 m-20 -34.0 -46.65 0.24 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.789 0.328 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -43.17 129.36 3.42 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.591 0.71 . . . . 0.0 110.907 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 146.03 59.04 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.3 t -69.01 145.28 53.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.88 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.406 ' O ' HG23 ' A' ' 465' ' ' THR . 29.4 tttp -80.09 -65.6 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.1 mt -44.73 -58.64 2.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -39.61 -25.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.49 ' N ' ' O ' ' A' ' 462' ' ' LEU . 43.8 m-70 -100.29 -52.46 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.855 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 464' ' ' HIS . 70.7 p -31.61 -45.31 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.15 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 76.7 p -126.01 -34.66 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.89 -37.69 1.98 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.499 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -108.58 140.73 41.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 110.866 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.3 t -100.55 135.18 42.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 471' ' ' ASN . 5.6 tp -61.2 -42.03 91.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.156 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . 0.438 ' N ' HG23 ' A' ' 470' ' ' ILE . 31.6 m-20 -51.84 -57.48 9.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 116.12 -149.0 18.88 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -75.76 -16.03 60.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 110.866 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.18 44.41 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.832 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 t -79.48 147.96 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.572 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.3 ppp? -76.14 -11.15 59.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.572 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.3 m-85 -107.96 160.19 15.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 74.8 m -77.77 143.48 37.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -114.73 31.79 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.841 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -72.87 159.43 85.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.606 0.717 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 120.86 7.58 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.687 2.258 . . . . 0.0 112.37 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.427 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 27.1 mt -42.99 148.51 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.7 p -131.11 154.77 47.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.156 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -39.95 -31.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -80.01 -74.13 0.32 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 70.1 p -42.83 -46.33 5.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.18 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.16 -46.5 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -55.9 -38.33 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.837 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 434' ' ' ARG . 34.7 mt -53.03 -65.86 0.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.921 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 84.3 mt -40.64 -56.6 2.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -39.95 -43.36 1.51 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.15 -59.94 2.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -41.41 -59.4 1.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.868 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.5 mp . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.985 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.464 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 24.2 mttm . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.79 0.329 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.526 ' HB3' HD23 ' A' ' 489' ' ' LEU . 0.2 OUTLIER -120.53 48.34 1.62 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -139.47 154.66 47.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.524 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 14.5 tp -70.16 143.26 52.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 22.6 t -74.11 146.69 43.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.892 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.484 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.2 OUTLIER -77.35 -12.5 59.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.912 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -104.49 -48.36 3.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.504 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 37.7 t80 -42.94 -36.38 1.52 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.941 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . 0.474 HG12 HD21 ' A' ' 436' ' ' LEU . 79.2 mt -40.1 -36.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.76 -34.68 10.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.96 -9.03 21.25 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -98.86 81.93 2.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.821 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.1 t -118.26 100.32 7.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.06 -59.61 1.43 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.103 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -74.46 96.19 2.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.18 -76.34 0.23 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.145 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.56 20.3 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -124.98 -1.32 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.2 t -80.16 111.24 20.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.644 0.735 . . . . 0.0 110.925 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 0.26 5.88 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.664 2.243 . . . . 0.0 112.348 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.464 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 78.5 m-85 -100.01 175.69 5.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 48.8 mmm -90.09 143.34 26.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.898 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.504 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 22.2 m170 -120.03 -75.85 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.28 -68.15 1.5 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.467 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.452 ' C ' ' O ' ' A' ' 456' ' ' GLY . 5.9 m-20 -34.5 -35.53 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.844 0.354 . . . . 0.0 110.862 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 20.7 t80 -51.81 124.05 26.45 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.663 0.744 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 140.99 43.87 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.721 2.281 . . . . 0.0 112.291 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.36 142.12 55.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.415 ' O ' HG23 ' A' ' 465' ' ' THR . 78.6 tttt -76.81 -65.59 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.885 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.9 mt -44.99 -58.25 3.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -40.72 -23.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.564 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.9 m-70 -100.37 -51.49 3.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.878 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.464 ' C ' ' O ' ' A' ' 464' ' ' HIS . 49.0 p -31.37 -40.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 464' ' ' HIS . 75.6 p -132.93 -32.75 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.53 -34.81 2.3 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -110.0 149.21 30.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 15.0 t -104.24 151.43 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.1 tp -79.33 -37.13 18.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.112 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -49.89 -65.94 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 139.67 -169.39 24.64 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.527 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.19 -24.54 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.35 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -104.9 46.92 0.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.75 147.62 47.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.528 ' SD ' ' CE1' ' A' ' 477' ' ' PHE . 5.2 ppp? -79.67 11.74 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.851 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.528 ' CE1' ' SD ' ' A' ' 476' ' ' MET . 14.0 m-85 -123.07 155.71 36.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 8.0 m -75.36 127.09 32.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -103.03 16.12 27.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.03 156.44 74.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.647 0.737 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 121.26 7.94 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.687 2.258 . . . . 0.0 112.342 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.564 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 59.3 mt -41.49 144.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.921 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 485' ' ' GLU . 4.4 p -138.11 158.12 44.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.162 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -38.69 -29.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 483' ' ' THR . 32.4 mt-10 -81.24 -75.77 0.27 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 489' ' ' LEU . 68.1 p -50.03 -47.52 53.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.139 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.09 -36.5 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -65.21 -41.61 94.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 434' ' ' ARG . 87.8 mt -46.9 -62.61 1.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 66.4 mt -40.32 -57.12 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -42.54 -38.24 1.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.853 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.98 -52.37 8.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.5 -60.83 2.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.932 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 25.0 mttm . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.762 0.315 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.45 ' HB3' HD22 ' A' ' 489' ' ' LEU . 7.6 mpt_? -105.53 44.67 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -113.71 152.17 30.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.897 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 37.4 tp -63.12 114.63 3.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.976 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.71 131.99 52.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.91 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 15.47 1.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.41 -37.11 3.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.438 ' CZ ' ' HE2' ' A' ' 476' ' ' MET . 34.9 t80 -68.09 -35.9 78.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.88 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.0 mt -43.19 -33.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.5 p -102.08 -36.47 8.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 120.09 -10.15 11.05 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . 0.418 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 8.2 t80 -99.65 85.86 3.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.871 0.367 . . . . 0.0 110.913 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.1 t -121.16 110.49 16.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.56 -70.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.095 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -78.59 107.73 11.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.844 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -75.32 0.26 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.7 2.99 23.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -114.35 15.78 17.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.413 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 36.8 t -80.59 111.2 20.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.646 0.736 . . . . 0.0 110.864 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.6 Cg_endo -69.7 -0.88 7.5 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.694 2.263 . . . . 0.0 112.367 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -101.88 179.76 4.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 34.4 mmm -99.98 139.29 35.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 26.2 m170 -113.17 -78.34 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.13 -63.12 1.91 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.507 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 42.6 t0 -32.71 -45.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.828 0.346 . . . . 0.0 110.926 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -46.91 124.59 8.15 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.608 0.718 . . . . 0.0 110.892 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 145.95 58.82 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.704 2.269 . . . . 0.0 112.333 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.475 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.5 t -64.48 144.41 57.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.843 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.457 ' O ' HG23 ' A' ' 465' ' ' THR . 24.2 ttpt -79.33 -67.15 0.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.1 mt -44.63 -59.17 2.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -39.67 -25.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.549 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 34.8 m-70 -99.89 -51.72 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 461' ' ' LYS . 44.5 p -35.58 -44.38 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.195 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 68.3 p -123.35 -35.03 3.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.37 -37.65 1.96 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.489 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -109.96 147.74 32.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.86 0.362 . . . . 0.0 110.855 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 38.2 t -103.2 147.56 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.879 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.443 HG23 ' N ' ' A' ' 471' ' ' ASN . 4.5 tp -70.6 -42.36 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . 0.443 ' N ' HG23 ' A' ' 470' ' ' ILE . 8.0 t-20 -51.91 -54.71 26.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 121.63 -153.24 16.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.434 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.44 -19.15 59.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.321 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -101.41 42.7 1.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.95 143.61 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.438 ' HE2' ' CZ ' ' A' ' 440' ' ' TYR . 5.3 ppp? -80.93 19.32 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.415 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 26.3 m-85 -126.38 158.61 35.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.882 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 13.2 m -76.47 120.29 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -100.84 32.66 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.821 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -77.71 161.51 71.45 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.588 0.709 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 116.93 4.79 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.712 2.275 . . . . 0.0 112.311 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.624 HD13 ' HG2' ' A' ' 487' ' ' ARG . 28.6 mt -40.98 150.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.2 p -133.27 154.92 50.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.154 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -40.48 -33.26 0.25 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -80.16 -74.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.521 ' HA ' HD12 ' A' ' 489' ' ' LEU . 32.1 p -46.95 -52.98 13.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.624 ' HG2' HD13 ' A' ' 482' ' ' LEU . 0.0 OUTLIER -40.96 -44.55 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -59.64 -38.29 80.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 486' ' ' THR . 55.0 mt -52.21 -65.54 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.936 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 78.1 mt -42.25 -57.59 2.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -39.89 -42.31 1.31 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -79.53 -48.32 14.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.913 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -51.5 -58.76 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 97.2 mt . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.925 -179.993 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.782 0.325 . . . . 0.0 110.864 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -123.62 46.21 2.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -114.45 165.72 12.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.562 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 27.2 tp -71.71 115.92 11.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.54 125.22 22.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -66.26 -3.76 6.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -100.08 -55.36 2.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.559 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 10.2 t80 -43.91 -36.36 2.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 39.5 mt -43.74 -38.44 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -35.02 9.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.53 -9.78 11.64 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -99.73 96.16 7.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.891 0.377 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 36.5 t -130.64 102.16 6.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.095 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -67.69 82.71 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -78.73 -57.47 3.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.058 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.88 -2.03 31.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.956 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 36.0 m-20 -134.85 37.49 3.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 53.2 t -80.76 111.04 19.87 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 110.896 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.4 Cg_endo -69.71 -2.5 10.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.712 2.275 . . . . 0.0 112.342 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -108.31 -177.24 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.893 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 38.3 mmm -100.26 147.78 25.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 23.4 m170 -122.57 -77.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.438 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.68 -65.73 1.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.488 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.4 m-20 -34.73 -39.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.562 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.7 t80 -50.44 124.59 18.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 0.0 110.826 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 141.08 44.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.339 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.0 t -65.9 141.07 58.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -78.01 -66.8 0.8 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.884 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.1 mt -45.37 -56.67 4.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -40.81 -24.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.502 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 40.9 m-70 -100.61 -53.66 3.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.862 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 464' ' ' HIS . 69.8 p -31.1 -41.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.15 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.431 ' N ' ' O ' ' A' ' 464' ' ' HIS . 39.2 p -129.81 -36.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 136.22 -37.85 1.84 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -106.66 142.74 35.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -100.51 144.45 29.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.6 tp -71.9 -36.57 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.149 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -52.21 -60.03 3.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.921 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 125.72 -156.01 19.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.512 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -71.97 -27.59 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 110.89 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -101.47 44.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -73.91 146.48 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.1 ppp? -80.6 17.52 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 25.4 m-85 -128.23 154.81 45.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.9 m -78.55 126.9 31.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -100.11 19.2 16.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.86 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.28 155.14 58.89 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.596 0.712 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 116.17 4.43 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.74 2.293 . . . . 0.0 112.324 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.623 HD11 ' CD1' ' A' ' 490' ' ' LEU . 12.7 mt -40.61 132.41 2.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.52 ' O ' ' CB ' ' A' ' 487' ' ' ARG . 69.2 p -112.71 167.13 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -49.61 -31.86 11.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -81.26 -77.0 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.885 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 49.9 p -45.62 -36.94 5.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.152 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 483' ' ' THR . 12.5 tpt180 -48.71 -40.92 30.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.859 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -61.45 -45.76 92.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 45.1 mt -41.41 -67.01 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.623 ' CD1' HD11 ' A' ' 482' ' ' LEU . 77.4 mt -40.78 -59.41 1.41 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -39.7 -41.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.87 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -79.63 -50.58 10.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.3 tmm? -57.93 -62.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.926 179.967 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.5 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 3.7 mmmp? . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.791 0.329 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 489' ' ' LEU . 5.7 tpt180 61.01 40.98 14.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -135.12 160.86 37.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.561 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 43.6 tp -60.75 112.92 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . 0.5 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 5.9 t -53.24 115.49 1.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -56.03 -12.18 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -101.0 -48.46 4.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.5 ' CB ' ' HB3' ' A' ' 437' ' ' CYS . 25.1 t80 -45.38 -40.75 8.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 54.1 mt -39.95 -31.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.116 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 81.7 p -102.15 -36.6 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.44 11.68 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.487 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -96.96 88.53 4.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.907 0.384 . . . . 0.0 110.848 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 12.6 t -126.37 110.49 13.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.76 -72.05 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.067 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 64.5 mtt180 -73.63 102.41 3.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.1 -72.14 0.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.112 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -76.43 -7.33 54.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.892 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.93 30.26 7.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.892 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 44.7 t -73.97 113.39 22.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.725 . . . . 0.0 110.865 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.3 Cg_endo -69.77 7.11 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.26 . . . . 0.0 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.5 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 49.3 m-85 -118.38 -175.23 2.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 27.4 mmm -101.15 134.85 43.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.425 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.5 m170 -113.58 -76.66 0.58 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.829 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.499 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -77.97 -70.64 1.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.499 ' C ' ' O ' ' A' ' 456' ' ' GLY . 2.6 m-20 -29.54 -42.84 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 0.0 110.862 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.561 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 17.9 t80 -48.16 125.84 11.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.668 0.747 . . . . 0.0 110.866 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 126.99 13.97 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.38 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.7 t -49.88 149.42 2.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -80.11 -67.9 0.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.504 ' O ' ' N ' ' A' ' 464' ' ' HIS . 48.0 mt -43.78 -60.42 1.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.422 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 92.4 t80 -39.22 -25.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.551 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.4 m-70 -99.0 -53.23 3.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 73.4 p -32.61 -43.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.142 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 82.7 p -127.37 -35.92 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.153 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.422 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.02 -40.42 1.45 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -105.04 172.65 6.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.3 t -129.56 119.18 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.905 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -51.94 -30.27 12.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -50.45 -63.35 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 143.57 -162.44 27.67 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.528 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.1 -37.6 75.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.864 0.364 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -99.88 65.14 1.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.887 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 20.9 t -78.18 151.88 32.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.8 ppp? -69.86 -19.41 63.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 20.5 m-85 -101.46 155.99 17.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 35.1 m -78.66 142.92 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.853 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -115.18 35.15 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.22 161.17 80.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.596 0.712 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 116.5 4.59 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.645 2.23 . . . . 0.0 112.348 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.551 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.0 mt -40.53 146.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.914 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 77.3 p -125.26 156.25 38.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.126 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -40.42 -33.57 0.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -80.46 -75.21 0.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.614 ' HA ' HD12 ' A' ' 489' ' ' LEU . 20.3 p -41.17 -49.52 3.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.18 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -46.92 2.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.97 -45.98 91.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 434' ' ' ARG . 80.7 mt -45.4 -62.24 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.946 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 38.8 mt -41.86 -61.31 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.906 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.8 -47.6 2.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -68.4 -43.47 77.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . 0.443 ' CE ' HD22 ' A' ' 494' ' ' LEU . 14.5 tmm? -56.92 -60.34 3.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.443 HD22 ' CE ' ' A' ' 493' ' ' MET . 4.0 mm? . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.46 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 26.2 mmmt . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.778 0.323 . . . . 0.0 110.911 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.755 ' O ' HD22 ' A' ' 489' ' ' LEU . 16.7 tpp180 60.64 35.74 19.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -128.02 176.31 7.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 33.8 tp -75.39 121.87 22.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.962 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . 0.45 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.2 t -59.82 131.38 50.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.889 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 2.05 7.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -119.0 -40.56 2.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.455 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 34.5 t80 -54.46 -28.37 43.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.8 mt -45.57 -32.4 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 p -102.31 -29.7 11.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.19 -10.33 17.57 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.497 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -99.98 97.95 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.848 0.356 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 11.6 t -131.63 108.01 9.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.896 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.65 -66.19 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.096 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 19.2 mtm-85 -71.19 104.89 3.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.861 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -77.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -81.7 -2.79 51.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -114.11 24.6 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.3 t -80.18 114.54 47.72 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.873 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.68 3.34 Favored 'Trans proline' 0 C--O 1.231 0.13 0 C-N-CA 122.675 2.25 . . . . 0.0 112.369 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.46 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 75.6 m-85 -115.53 -174.37 2.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 31.8 mmm -100.03 150.19 22.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.877 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.455 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 30.3 m170 -125.65 -77.21 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -81.13 -60.09 2.32 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.465 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -39.32 -43.46 1.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 20.3 t80 -46.61 127.7 8.21 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.662 0.744 . . . . 0.0 110.903 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 140.27 42.14 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.7 146.34 49.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.584 ' NZ ' HD23 ' A' ' 494' ' ' LEU . 34.4 tttp -80.14 -68.72 0.65 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.902 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.7 mt -44.89 -56.85 4.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.443 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 44.7 t80 -40.0 -27.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.554 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 32.5 m-70 -98.63 -52.69 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 461' ' ' LYS . 31.9 p -34.21 -35.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 464' ' ' HIS . 76.8 p -132.74 -39.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.124 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.443 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.82 -38.99 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.501 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -109.14 152.16 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.859 0.362 . . . . 0.0 110.895 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 37.9 t -105.35 141.44 36.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.1 tp -72.91 -31.94 37.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -50.83 -68.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 144.45 -157.19 27.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.51 -29.06 61.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.779 0.323 . . . . 0.0 110.864 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.51 53.91 0.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.2 t -73.61 148.47 42.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.487 ' SD ' ' CZ ' ' A' ' 477' ' ' PHE . 4.4 ppp? -79.3 11.05 3.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.881 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.487 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 12.6 m-85 -124.59 158.1 33.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 2.8 m -76.8 134.02 39.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -109.33 20.27 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.826 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . 0.413 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 0.0 OUTLIER -67.79 158.92 81.63 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.601 0.715 . . . . 0.0 110.86 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.1 Cg_endo -69.73 117.85 5.33 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.672 2.248 . . . . 0.0 112.374 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.554 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 88.8 mt -39.29 140.1 0.46 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 12.1 p -120.44 154.56 35.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -41.1 -29.12 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -79.97 -75.56 0.25 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.89 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.2 p -46.25 -47.88 18.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.121 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -39.68 -39.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.25 -38.91 91.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 434' ' ' ARG . 84.2 mt -50.44 -61.66 2.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 57.1 mt -41.43 -55.72 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -39.71 -45.37 1.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.861 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.17 -36.87 39.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -65.27 -66.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.584 HD23 ' NZ ' ' A' ' 461' ' ' LYS . 16.2 mt . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 49.5 mttp . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.79 0.328 . . . . 0.0 110.918 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.401 ' C ' ' CD ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -91.28 33.65 0.97 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -107.99 143.94 35.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.578 HD13 ' CD2' ' A' ' 458' ' ' PHE . 31.7 tp -66.98 120.66 14.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 33.3 t -59.12 134.02 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -79.37 12.08 2.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -117.71 -41.94 2.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -59.14 -33.41 70.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 70.6 mt -42.83 -33.0 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.4 p -101.48 -37.13 8.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.138 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.5 -8.42 17.58 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -100.13 80.97 2.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.897 0.38 . . . . 0.0 110.865 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 47.1 t -118.56 104.62 10.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.96 -64.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 79.3 mtt180 -78.21 105.56 9.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.852 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.42 -77.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.91 14.3 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.838 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -113.29 -17.25 12.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.856 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 8.0 t -65.95 111.21 5.9 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.552 0.692 . . . . 0.0 110.895 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 3.64 2.62 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.349 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -100.17 170.69 8.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 17.6 mmm -81.94 141.28 33.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -120.91 -77.61 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.8 -60.17 2.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.7 m-20 -34.45 -46.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.775 0.321 . . . . 0.0 110.832 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.578 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.6 t80 -46.65 126.21 8.09 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.664 0.745 . . . . 0.0 110.855 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 134.42 27.94 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.688 2.258 . . . . 0.0 112.331 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.4 t -53.16 145.19 14.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.484 ' O ' HG23 ' A' ' 465' ' ' THR . 21.0 tttm -80.12 -67.64 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.6 mt -44.76 -58.83 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.942 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.449 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 25.1 t80 -39.43 -25.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.96 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.516 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 30.4 m-70 -99.98 -54.15 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 461' ' ' LYS . 33.8 p -33.79 -40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 80.6 p -126.92 -33.18 2.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.127 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.449 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 131.81 -40.24 1.66 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.505 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -109.8 149.92 29.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 0.0 110.899 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.62 143.8 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.8 tp -71.34 -39.09 71.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.096 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.74 -68.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 141.58 -154.81 24.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.498 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -74.38 -24.49 59.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -101.69 49.27 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -79.26 148.08 32.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.522 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 3.6 ppp? -80.57 17.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.522 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 12.4 m-85 -129.43 157.38 42.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.5 p -80.07 128.68 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.877 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -103.87 21.94 15.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.46 158.67 86.26 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.614 0.721 . . . . 0.0 110.845 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 119.28 6.26 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.665 2.243 . . . . 0.0 112.387 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.516 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 39.8 mt -42.5 150.2 0.15 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.947 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.0 p -128.79 154.9 45.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.145 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -39.92 -30.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -80.66 -75.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 489' ' ' LEU . 20.7 p -46.99 -46.84 21.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.146 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -43.58 1.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -58.29 -40.5 82.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.937 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' A' ' 486' ' ' THR . 48.6 mt -49.87 -64.29 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 482' ' ' LEU . 85.2 mt -42.99 -54.0 4.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -41.38 -44.9 2.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -78.07 -59.18 2.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -44.19 -60.14 2.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.895 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 55.4 mt . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 -179.995 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.82 0.343 . . . . 0.0 110.901 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.465 ' CG ' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -105.67 47.59 0.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.844 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -124.82 143.7 50.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.881 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 458' ' ' PHE . 20.6 tp -73.59 102.65 3.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.89 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.8 t -40.02 124.1 1.76 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.883 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -68.05 -3.02 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -102.37 -51.52 3.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -47.78 -37.77 14.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.963 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.7 mt -41.17 -31.09 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.123 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 40.6 p -103.05 -33.93 9.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.94 -10.47 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.497 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -99.97 97.82 8.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 110.902 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.67 110.2 9.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.878 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.092 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.432 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 68.4 mtt180 -77.5 109.54 11.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.841 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.62 -77.16 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.125 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.74 5.8 17.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -103.29 -20.07 14.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.922 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 10.2 t -60.86 110.26 2.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.611 0.719 . . . . 0.0 110.872 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.4 Cg_endo -69.75 4.27 2.29 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.8 178.33 4.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.918 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 22.7 mmm -91.62 140.42 29.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -120.59 -76.17 0.58 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.49 -64.95 1.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.495 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 28.0 t0 -32.6 -48.01 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.82 0.343 . . . . 0.0 110.871 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.9 t80 -40.55 125.92 1.84 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.759 . . . . 0.0 110.886 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 155.74 65.05 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.637 2.225 . . . . 0.0 112.36 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.514 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 14.0 t -73.5 146.03 45.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 465' ' ' THR . 45.5 tttp -79.54 -69.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.3 mt -44.14 -59.56 2.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.432 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 58.3 t80 -39.56 -25.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.553 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.7 m-70 -98.94 -50.83 4.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.823 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 464' ' ' HIS . 55.2 p -35.59 -43.24 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 32.5 p -125.96 -33.75 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.158 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.432 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 135.15 -38.12 1.84 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.514 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -108.56 166.24 10.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.2 t -126.25 131.77 51.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 470' ' ' ILE . 5.4 tp -80.66 21.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -99.57 -46.89 5.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 114.81 174.31 18.24 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.503 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.5 -17.38 13.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -101.56 43.49 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.83 146.18 44.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.6 ppp? -71.59 -22.05 61.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.854 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 16.9 m-85 -100.55 159.19 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.6 m -79.94 135.9 36.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -101.02 24.46 9.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -62.51 153.44 77.16 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.582 0.705 . . . . 0.0 110.876 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 119.94 6.81 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.693 2.262 . . . . 0.0 112.355 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.556 HD21 HD11 ' A' ' 490' ' ' LEU . 80.0 mt -41.18 143.73 0.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 10.7 p -138.65 162.0 35.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.105 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -39.46 -35.63 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -80.22 -68.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.853 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 489' ' ' LEU . 5.7 p -52.89 -55.13 25.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.154 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.29 -49.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -52.24 -39.18 59.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.465 ' CD2' ' CG ' ' A' ' 434' ' ' ARG . 65.1 mt -49.6 -65.89 0.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.556 HD11 HD21 ' A' ' 482' ' ' LEU . 72.7 mt -39.81 -61.12 0.88 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.917 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.91 -39.56 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.842 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -79.47 -40.89 28.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -62.21 -59.76 4.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.872 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 3.8 mm? . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 -180.0 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 452' ' ' PRO . 41.2 mttt . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.81 0.338 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.412 ' HD3' ' O ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -97.76 33.78 2.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.893 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -115.84 149.18 39.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.894 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.515 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.7 tp -79.39 105.45 10.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 23.5 t -41.79 131.48 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -80.95 21.79 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.901 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -125.33 -42.2 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.905 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -64.01 -27.7 69.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 96.5 mt -44.72 -37.19 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.3 -27.76 13.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.177 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.62 -10.17 16.45 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -100.73 105.76 17.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.891 0.377 . . . . 0.0 110.884 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 40.4 t -138.45 122.26 17.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.869 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -46.18 -67.45 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.155 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -86.12 114.47 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.64 -79.17 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.155 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -81.74 12.79 3.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -116.55 1.73 12.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 12.9 t -80.18 110.99 18.54 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.621 0.724 . . . . 0.0 110.866 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.47 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.3 Cg_endo -69.77 7.08 1.08 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -99.25 -177.15 3.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 44.3 mmm -97.84 126.25 43.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.873 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -109.95 -74.89 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.51 -60.28 2.37 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.458 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 51.6 m-20 -34.48 -45.46 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.858 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.515 ' CD2' HD13 ' A' ' 436' ' ' LEU . 27.8 t80 -47.03 128.77 9.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.654 0.74 . . . . 0.0 110.879 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 150.79 68.92 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.323 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.405 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.6 t -75.72 150.07 37.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 465' ' ' THR . 9.3 ttmt -80.01 -68.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.5 mt -45.5 -57.54 4.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 64.5 t80 -40.71 -24.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.565 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.9 m-70 -99.9 -53.39 3.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 461' ' ' LYS . 43.6 p -34.7 -43.48 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.105 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 72.2 p -124.68 -35.23 2.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.13 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 136.46 -38.57 1.75 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.531 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -107.09 169.83 8.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 16.8 t -124.56 133.76 53.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.39 -38.84 82.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -50.28 -54.83 18.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 124.16 -159.35 18.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.449 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.77 -25.11 61.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.775 0.321 . . . . 0.0 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -99.95 47.21 0.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 33.9 t -78.1 149.41 33.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.6 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -80.66 18.54 0.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.6 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 20.2 m-85 -131.39 156.05 46.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.4 m -79.0 128.33 33.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.86 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -103.02 25.13 9.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.831 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.23 160.3 79.44 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.593 0.711 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 116.84 4.75 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.647 2.232 . . . . 0.0 112.359 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.565 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 37.8 mt -40.18 144.85 0.19 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 72.3 p -131.91 160.26 36.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -41.32 -32.67 0.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -78.27 -71.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.5 p -48.91 -51.15 31.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.126 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.47 -52.61 2.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.855 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -51.04 -49.7 60.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 94.2 mt -43.9 -65.18 0.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 35.9 mt -40.01 -57.32 1.66 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.7 -40.4 5.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.81 -52.43 9.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.3 tmm? -53.83 -64.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.933 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.796 0.332 . . . . 0.0 110.91 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.543 ' HB3' HD23 ' A' ' 489' ' ' LEU . 8.2 mpt_? -92.63 41.67 1.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -122.12 152.68 39.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.52 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 13.4 tp -78.93 115.75 18.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 27.0 t -45.68 131.11 9.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -75.24 0.55 16.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -108.17 -50.11 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.434 ' CE2' ' HE1' ' A' ' 476' ' ' MET . 11.7 t80 -49.05 -30.05 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.8 mt -44.46 -33.75 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.086 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 60.2 p -103.91 -29.23 11.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.107 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.11 -10.11 22.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -98.6 99.38 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.86 104.81 5.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.44 -61.78 0.87 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.134 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -81.92 104.64 12.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.08 -74.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.087 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -81.42 2.7 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.899 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -104.51 -5.26 21.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.3 t -72.56 111.59 11.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.624 0.726 . . . . 0.0 110.864 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 2.02 3.88 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.688 2.259 . . . . 0.0 112.388 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -100.32 -174.64 2.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 29.1 mmm -98.19 142.34 29.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.877 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -121.23 -75.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.469 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.69 -66.28 1.65 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.43 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.469 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -33.0 -42.57 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.863 0.363 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.52 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.8 t80 -46.79 126.93 8.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.684 0.754 . . . . 0.0 110.861 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 144.94 55.45 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.255 . . . . 0.0 112.333 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 51.9 t -69.26 143.24 53.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.429 ' O ' HG23 ' A' ' 465' ' ' THR . 4.7 ttpm? -79.38 -65.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.89 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.5 mt -45.0 -57.84 3.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -40.51 -24.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.574 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 45.1 m-70 -100.66 -52.49 3.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.458 ' C ' ' O ' ' A' ' 464' ' ' HIS . 58.3 p -32.24 -42.28 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.158 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 62.8 p -127.84 -36.92 1.97 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.15 -33.18 2.56 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.475 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -116.81 143.73 45.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.839 0.352 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.4 t -101.92 107.33 18.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.6 tp -40.49 -36.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.185 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -53.2 -61.87 2.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 107.45 -142.07 15.74 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.18 13.43 2.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.841 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -106.72 -25.22 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.895 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -43.14 125.87 3.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.605 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 0.8 OUTLIER -81.56 27.2 0.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.1 m-85 -125.29 158.1 34.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.6 m -80.12 137.68 36.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.831 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 38.0 m170 -108.59 17.98 21.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -60.31 153.43 58.78 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 117.13 4.9 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.709 2.273 . . . . 0.0 112.351 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 490' ' ' LEU . 23.7 mt -39.65 151.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 40.5 p -139.18 165.58 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.113 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . 0.43 ' HG3' ' CD ' ' A' ' 485' ' ' GLU . 9.9 pt-20 -40.27 -38.5 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.43 ' CD ' ' HG3' ' A' ' 484' ' ' GLU . 48.0 mp0 -80.43 -76.3 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.915 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.446 ' O ' ' N ' ' A' ' 489' ' ' LEU . 17.4 p -41.49 -50.92 3.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.124 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.474 ' HD3' HD13 ' A' ' 482' ' ' LEU . 12.0 tpt180 -39.41 -44.36 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.15 -40.08 80.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 434' ' ' ARG . 88.3 mt -46.68 -68.14 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 482' ' ' LEU . 92.8 mt -40.43 -57.55 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -42.54 -36.11 1.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -80.17 -38.47 31.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -68.88 -62.64 1.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.829 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.0 mm? . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.896 -179.956 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.777 0.323 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 57.48 42.08 25.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -138.32 154.29 48.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.624 HD13 ' CD2' ' A' ' 458' ' ' PHE . 32.8 tp -79.54 105.09 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.7 t -40.52 123.78 1.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -69.41 -3.16 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -105.28 -51.43 3.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.423 ' HB2' ' NE2' ' A' ' 455' ' ' HIS . 31.6 t80 -44.58 -37.64 3.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -41.03 -36.24 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.147 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 11.1 p -101.21 -35.23 9.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.99 -9.81 11.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.489 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . 0.462 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 5.5 t80 -95.31 83.25 3.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.904 0.383 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 22.1 t -118.42 113.93 22.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -43.95 -72.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.114 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 84.2 mtt85 -80.17 109.41 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.65 -73.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -76.06 -5.66 47.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -110.47 20.34 17.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 37.6 t -80.53 111.81 25.99 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.629 0.728 . . . . 0.0 110.909 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 1.43 4.46 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.691 2.261 . . . . 0.0 112.359 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -105.67 -176.08 2.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . 0.484 ' CE ' ' HB2' ' A' ' 457' ' ' ASP . 29.1 mmm -100.78 140.58 34.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.924 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.423 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.4 m170 -119.9 -75.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -78.13 -67.3 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.484 ' HB2' ' CE ' ' A' ' 454' ' ' MET . 7.5 m-20 -32.99 -44.72 0.12 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.856 0.36 . . . . 0.0 110.884 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.624 ' CD2' HD13 ' A' ' 436' ' ' LEU . 15.2 t80 -45.28 126.24 5.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.633 0.73 . . . . 0.0 110.897 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 143.58 51.48 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.699 2.266 . . . . 0.0 112.341 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.432 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.1 t -70.69 145.03 50.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 19.9 ttpp -77.25 -64.99 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.8 mt -44.73 -59.44 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.446 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 87.5 t80 -39.62 -25.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 462' ' ' LEU . 42.9 m-70 -98.87 -53.61 3.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.885 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 464' ' ' HIS . 51.2 p -34.48 -34.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.126 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.0 p -133.59 -40.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.124 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.446 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 141.22 -38.57 1.52 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.46 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.43 152.1 30.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.1 t -102.26 141.73 34.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.446 HG22 HD13 ' A' ' 462' ' ' LEU . 8.3 tp -80.23 -26.08 11.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -50.92 -49.61 59.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 129.64 -167.17 21.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.478 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.49 -35.79 79.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.831 0.348 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -100.57 58.8 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.66 149.08 40.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.934 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -76.51 6.57 5.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 15.7 m-85 -125.78 154.74 42.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.844 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 23.3 m -80.37 141.44 35.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.25 26.98 10.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -64.97 153.76 88.02 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.624 0.726 . . . . 0.0 110.869 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 109.66 2.35 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.698 2.266 . . . . 0.0 112.39 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.447 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 47.4 mt -39.73 152.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' N ' ' A' ' 485' ' ' GLU . 72.5 p -137.46 158.51 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -38.95 -30.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.858 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.2 mm-40 -81.4 -74.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.42 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.1 p -46.24 -47.61 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.14 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.11 -47.04 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.86 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -56.99 -41.38 78.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 486' ' ' THR . 74.1 mt -47.66 -63.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 494' ' ' LEU . 72.1 mt -39.87 -60.03 1.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.929 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -40.26 -45.94 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.883 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 44.3 tttp -72.42 -49.11 35.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -48.23 -59.22 3.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 490' ' ' LEU . 4.0 mm? . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.467 ' HD3' ' CE2' ' A' ' 453' ' ' TYR . 6.9 mtpt . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.752 0.31 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.472 ' CG ' HD21 ' A' ' 489' ' ' LEU . 0.1 OUTLIER 58.83 38.35 24.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.85 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.04 135.14 32.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.739 HD13 ' CD2' ' A' ' 458' ' ' PHE . 53.9 tp -60.61 117.42 5.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 28.3 t -58.86 126.4 27.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.841 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.32 29.03 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -134.61 -42.09 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.605 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 47.1 t80 -66.91 -21.86 65.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.905 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 61.7 mt -52.84 -32.8 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.143 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 61.1 p -108.26 11.29 27.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.57 -8.73 25.67 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -99.67 99.62 10.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.3 t -136.26 117.25 14.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.09 -67.59 0.27 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.081 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -85.72 114.41 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.21 -76.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.128 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -81.41 -2.57 49.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -105.59 11.99 31.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 20.1 t -80.81 111.32 22.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.631 0.729 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 0.77 5.2 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.675 2.25 . . . . 0.0 112.331 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.467 ' CE2' ' HD3' ' A' ' 433' ' ' LYS . 57.6 m-85 -100.3 -174.97 2.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.4 mmm -100.54 143.03 31.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.922 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 440' ' ' TYR . 13.6 m170 -122.04 -75.28 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.64 -69.44 1.4 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.466 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.491 ' C ' ' O ' ' A' ' 456' ' ' GLY . 20.3 t0 -31.05 -41.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.739 ' CD2' HD13 ' A' ' 436' ' ' LEU . 14.7 t80 -49.31 117.78 7.16 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.864 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 129.45 17.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.721 2.281 . . . . 0.0 112.311 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 138.17 13.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -73.99 -66.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 49.0 mt -45.02 -58.7 3.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' A' ' 467' ' ' GLY . 69.4 t80 -39.74 -24.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.58 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 44.4 m-70 -100.75 -53.19 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.826 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.4 p -29.64 -42.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.193 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 464' ' ' HIS . 65.9 p -126.66 -39.53 1.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 463' ' ' TYR . . . 146.72 -38.06 1.16 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.51 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . 0.411 ' C ' ' HA ' ' A' ' 463' ' ' TYR . 45.1 p-10 -113.83 168.93 9.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.855 0.359 . . . . 0.0 110.918 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.33 140.38 48.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.448 HG22 HD13 ' A' ' 462' ' ' LEU . 7.9 tp -76.98 -33.28 20.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.102 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -50.42 -65.46 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 145.87 -164.35 28.2 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.502 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.15 -22.63 59.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.822 0.344 . . . . 0.0 110.888 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -99.76 48.89 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -79.46 141.32 36.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.605 ' CE ' ' CE2' ' A' ' 440' ' ' TYR . 4.7 ppp? -81.11 25.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 24.1 m-85 -134.59 157.23 47.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.86 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.5 p -80.1 135.47 36.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -111.49 28.15 9.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.881 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.47 163.32 69.1 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.608 0.718 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 120.08 6.92 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.701 2.268 . . . . 0.0 112.318 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.58 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.3 mt -40.91 143.79 0.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 39.4 p -126.54 156.09 41.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -39.87 -34.1 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -76.74 -74.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.879 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 20.4 p -45.16 -50.44 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.465 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.03 -49.59 1.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -50.83 -45.31 59.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.472 HD21 ' CG ' ' A' ' 434' ' ' ARG . 93.8 mt -48.2 -64.1 0.89 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.523 HD11 HD21 ' A' ' 482' ' ' LEU . 97.1 mt -39.82 -53.75 2.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -46.13 -47.33 17.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.843 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -73.66 -57.74 3.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.86 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -46.4 -64.23 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.869 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 490' ' ' LEU . 10.5 mp . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.953 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.551 ' HE3' ' CE1' ' A' ' 453' ' ' TYR . 22.6 mtmt . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.787 0.327 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 38.14 50.33 1.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . 0.475 ' HB3' ' CD2' ' A' ' 453' ' ' TYR . 14.2 tt0 -138.07 145.05 41.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.918 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.411 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.6 tp -72.99 112.26 8.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.938 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 18.5 t -43.28 141.75 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.476 ' HG2' ' CD1' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -79.89 -5.64 55.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.91 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . 0.476 ' CD1' ' HG2' ' A' ' 438' ' ' LYS . 46.3 m-85 -110.17 -54.03 2.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -42.2 -23.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.9 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 439' ' ' PHE . 61.8 mt -50.53 -40.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.107 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 41.3 p -99.71 6.24 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.158 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 79.87 -9.61 44.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.464 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -99.85 100.88 11.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.369 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.3 t -131.41 122.96 27.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.5 -59.08 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.118 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 97.0 mtt180 -88.65 107.96 19.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.81 -77.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -82.59 25.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -132.87 0.85 3.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.928 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 6.9 t -78.89 111.73 21.96 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.66 0.743 . . . . 0.0 110.869 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 5.17 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.716 2.277 . . . . 0.0 112.291 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.551 ' CE1' ' HE3' ' A' ' 433' ' ' LYS . 20.7 m-85 -99.93 -176.27 3.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.967 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.2 mmm -95.43 134.61 38.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -117.19 -75.51 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.29 -62.15 2.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.477 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 10.0 m-20 -34.74 -50.69 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 0.0 110.823 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 436' ' ' LEU . 21.3 t80 -40.14 123.97 1.67 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 0.0 110.865 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 151.5 69.19 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.638 2.225 . . . . 0.0 112.322 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.543 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.8 t -73.95 145.96 44.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.404 ' O ' HG23 ' A' ' 465' ' ' THR . 29.6 tttt -78.76 -68.06 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.3 mt -44.25 -59.73 2.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.472 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 70.7 t80 -39.5 -25.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.924 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 30.2 m-70 -99.08 -52.93 3.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.429 ' C ' ' O ' ' A' ' 464' ' ' HIS . 53.1 p -34.75 -35.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.3 p -132.96 -37.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.472 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.34 -41.22 1.35 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.513 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.96 165.71 11.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.896 0.379 . . . . 0.0 110.87 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 47.5 t -117.9 150.16 39.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.9 tp -79.83 -34.85 15.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.154 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -53.54 -66.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 135.85 -171.08 22.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.445 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -35.02 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.818 0.342 . . . . 0.0 110.854 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -100.22 59.85 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 24.7 t -79.47 152.51 30.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.586 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 3.6 ppp? -68.73 -21.79 64.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.912 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.586 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.6 m-85 -105.51 159.41 15.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 27.3 m -79.12 140.38 37.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -104.24 24.34 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.16 154.6 60.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.6 0.714 . . . . 0.0 110.856 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 120.08 6.93 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.731 2.288 . . . . 0.0 112.347 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.517 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 41.1 mt -40.14 143.34 0.29 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 46.8 p -126.71 153.35 45.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.104 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 485' ' ' GLU . 4.3 pt-20 -40.26 -30.78 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.451 ' N ' ' HG3' ' A' ' 484' ' ' GLU . 11.5 tp10 -80.31 -73.64 0.35 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 60.2 p -45.0 -48.03 11.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.13 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.67 -42.27 1.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.832 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -61.31 -43.78 98.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.874 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 23.4 mt -45.03 -64.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.41 HD11 HD21 ' A' ' 482' ' ' LEU . 75.1 mt -39.87 -57.27 1.62 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.951 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.38 -43.58 1.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -79.0 -51.92 8.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.9 tmm? -53.69 -63.31 1.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 21.4 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 -179.994 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.766 0.317 . . . . 0.0 110.872 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.02 54.19 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . 0.423 ' OE2' ' N ' ' A' ' 436' ' ' LEU . 0.8 OUTLIER -131.08 138.68 49.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.53 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 40.2 tp -57.91 114.42 2.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.8 t -47.72 138.42 8.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.92 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -77.02 -3.38 38.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -110.18 -51.06 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -43.15 -35.75 1.47 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.8 mt -39.89 -37.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 16.5 p -99.35 -36.01 9.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.162 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.08 11.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -97.19 88.88 4.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.875 0.369 . . . . 0.0 110.888 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 51.2 t -128.28 99.38 5.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.854 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -38.63 -61.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.108 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.448 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 61.9 mtt180 -77.31 105.18 8.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.58 -76.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 449' ' ' GLU . 32.2 tt0 -82.92 7.02 16.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -107.56 -12.03 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 18.4 t -68.63 111.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.587 0.708 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 4.47 2.19 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.672 2.248 . . . . 0.0 112.326 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -99.6 176.46 5.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.927 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 15.1 mmm -88.65 140.95 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.891 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -122.14 -74.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.505 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.39 -67.97 1.51 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.455 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.505 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.4 m-20 -29.94 -49.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.884 0.373 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.53 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.4 t80 -41.57 128.2 2.36 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.645 0.736 . . . . 0.0 110.884 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 150.01 67.59 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.67 2.247 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 52.8 t -72.23 142.29 48.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -76.83 -66.47 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 464' ' ' HIS . 33.0 mt -45.81 -57.76 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -42.48 -23.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.933 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.566 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 29.1 m-70 -99.02 -50.17 4.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.491 ' C ' ' O ' ' A' ' 464' ' ' HIS . 72.0 p -30.51 -47.84 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.118 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.9 p -127.23 -31.91 2.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.163 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.68 -34.05 2.46 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -110.46 145.33 37.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 0.0 110.902 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.0 t -106.36 118.64 37.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -50.26 -37.84 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -49.92 -50.45 46.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 106.4 -152.86 17.03 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.496 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -80.07 12.91 2.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 0.0 110.845 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -123.95 34.35 5.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 45.6 t -79.56 139.58 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.41 ' SD ' ' O ' ' A' ' 476' ' ' MET . 4.4 ppp? -81.1 22.46 0.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.401 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 16.0 m-85 -130.9 161.49 31.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.863 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.9 m -80.1 127.11 31.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.852 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -99.68 26.65 6.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.832 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . 0.41 ' HB2' ' HD2' ' A' ' 481' ' ' PRO . 3.1 p30 -69.68 154.86 94.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 480' ' ' ASP . 53.5 Cg_endo -69.76 120.55 7.32 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.714 2.276 . . . . 0.0 112.372 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.566 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 54.4 mt -39.79 132.06 1.76 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.423 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 69.4 p -109.45 172.24 6.97 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -49.7 -35.68 22.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' A' ' 486' ' ' THR . 9.4 tp10 -78.54 -75.33 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 485' ' ' GLU . 49.6 p -36.37 -52.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.134 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.6 OUTLIER -39.99 -47.12 2.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.09 -44.35 95.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 486' ' ' THR . 78.1 mt -48.85 -65.68 0.53 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 45.2 mt -40.08 -55.27 2.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -42.81 -41.67 3.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 492' ' ' LYS . 7.2 tmtm? -76.9 -53.26 8.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -50.87 -58.96 4.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.847 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.87 -179.924 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 63.1 mttt . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.744 0.307 . . . . 0.0 110.874 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -79.05 48.31 0.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.862 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -121.64 152.39 39.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 40.5 tp -67.52 124.0 22.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.935 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 17.1 t -57.26 127.6 32.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.04 -3.38 16.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -107.62 -44.06 4.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.45 ' CD2' ' CG ' ' A' ' 455' ' ' HIS . 30.4 t80 -51.65 -38.57 55.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.902 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.7 mt -39.58 -35.38 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.119 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.97 -31.27 11.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.133 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 112.89 -4.22 25.79 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.479 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . 0.451 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -100.33 85.91 3.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.875 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 48.6 t -121.27 102.54 8.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.867 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.14 -69.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.8 mtt85 -76.9 104.65 7.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.909 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.94 -74.55 0.32 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -81.93 21.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.944 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -128.82 -4.28 5.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 32.8 t -70.66 111.74 10.68 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.632 0.729 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 2.39 3.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 44.4 m-85 -100.99 177.14 5.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 37.8 mmm -90.97 142.54 27.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.45 ' CG ' ' CD2' ' A' ' 440' ' ' TYR . 18.5 m170 -120.36 -75.77 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.46 -64.84 1.79 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.457 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -32.29 -47.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 21.6 t80 -46.16 122.59 6.43 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.727 . . . . 0.0 110.864 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 143.86 51.8 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.325 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.6 t -65.7 135.56 55.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 465' ' ' THR . 6.5 ttpt -73.44 -64.96 0.88 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 464' ' ' HIS . 44.3 mt -44.44 -58.31 3.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.401 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 28.0 t80 -39.11 -25.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' A' ' 462' ' ' LEU . 64.3 m-70 -100.67 -55.33 2.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.822 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 461' ' ' LYS . 30.2 p -32.98 -39.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.2 p -128.58 -38.29 1.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.401 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 138.27 -38.26 1.71 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.523 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -111.01 155.42 22.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.856 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 23.9 t -106.52 136.09 46.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.404 HG22 HD13 ' A' ' 462' ' ' LEU . 6.1 tp -76.07 -25.97 17.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -56.33 -39.38 72.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 109.75 -161.11 13.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.516 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.8 -13.75 59.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.832 0.349 . . . . 0.0 110.935 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -99.98 29.62 4.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -71.96 131.37 42.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.491 ' C ' ' SD ' ' A' ' 476' ' ' MET . 0.0 OUTLIER -81.25 34.04 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.449 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 10.7 m-85 -132.92 155.12 49.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.922 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.7 m -80.18 127.91 32.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -99.76 15.67 26.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.31 156.23 61.92 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.597 0.713 . . . . 0.0 110.864 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 119.71 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.615 2.21 . . . . 0.0 112.35 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.525 HD11 ' CD1' ' A' ' 490' ' ' LEU . 29.0 mt -39.87 147.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 82.1 p -126.27 157.86 37.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.095 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -41.91 -33.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -80.96 -76.4 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 489' ' ' LEU . 59.6 p -44.92 -48.99 11.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.165 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -38.86 -45.16 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -56.22 -41.31 75.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 486' ' ' THR . 51.9 mt -45.88 -62.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.525 ' CD1' HD11 ' A' ' 482' ' ' LEU . 81.8 mt -41.74 -56.55 2.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.958 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -42.72 -41.99 3.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -80.2 -60.01 2.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . 0.511 ' CE ' HD12 ' A' ' 494' ' ' LEU . 13.4 tmm? -41.6 -57.4 2.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.895 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . 0.511 HD12 ' CE ' ' A' ' 493' ' ' MET . 10.4 mp . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.933 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 18.5 mttp . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.753 0.311 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -118.88 44.77 2.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -120.16 154.48 34.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.897 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 35.6 tp -70.86 129.02 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.4 t -66.0 131.63 46.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.919 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.42 2.53 9.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.933 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -114.95 -47.46 2.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -48.17 -35.2 11.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.9 mt -41.12 -33.85 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.168 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 66.6 p -99.74 -33.33 10.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.09 -9.08 13.95 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.15 98.57 9.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.378 . . . . 0.0 110.834 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.6 t -134.5 111.56 10.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.04 -62.08 0.78 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 45.6 mtt180 -85.28 111.07 19.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.93 -79.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.086 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.06 0.99 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -102.17 -5.07 24.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 9.7 t -70.38 111.92 11.07 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.59 0.71 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.659 2.239 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.524 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -100.29 -176.17 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.93 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 21.2 mmm -97.36 138.75 34.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.5 m170 -119.82 -75.39 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.43 -62.26 2.09 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.455 ' C ' ' O ' ' A' ' 456' ' ' GLY . 68.9 m-20 -34.18 -50.92 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 110.875 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -40.84 127.96 1.94 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.679 0.752 . . . . 0.0 110.886 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 140.42 42.69 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.681 2.254 . . . . 0.0 112.354 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 13.7 t -59.13 144.28 46.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.902 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 56.1 tttp -77.97 -68.84 0.59 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.86 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.579 HD13 HG22 ' A' ' 470' ' ' ILE . 29.8 mt -45.15 -58.09 3.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.448 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 54.9 t80 -40.25 -24.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.897 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.55 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.5 m-70 -100.17 -52.42 3.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.433 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.6 p -33.44 -41.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.149 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 38.1 p -128.37 -29.22 2.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.448 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 128.75 -38.74 1.99 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.439 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -109.83 149.08 30.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.851 0.358 . . . . 0.0 110.885 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.1 t -102.22 131.43 48.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.898 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.579 HG22 HD13 ' A' ' 462' ' ' LEU . 8.5 tp -77.73 -21.94 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.143 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -50.63 -48.25 58.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 132.14 -168.97 22.33 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.508 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.94 -33.81 72.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.842 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.02 64.06 0.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.0 t -73.58 153.35 40.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.895 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.535 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.9 ppp? -75.61 -20.03 58.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.535 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 18.0 m-85 -104.26 161.17 14.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.867 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 68.5 m -79.97 151.27 30.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 48.6 m170 -115.04 30.2 7.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.91 157.86 85.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.586 0.708 . . . . 0.0 110.906 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 131.27 20.8 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.713 2.275 . . . . 0.0 112.306 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.55 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 38.6 mt -56.15 149.38 16.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 485' ' ' GLU . 66.4 p -136.35 154.97 50.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.132 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.79 -29.7 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.4 mt-10 -78.94 -74.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.913 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.3 p -48.6 -50.64 31.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.108 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -48.53 2.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.852 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -52.52 -40.77 62.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 77.2 mt -53.26 -61.25 2.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.872 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 94.9 mt -41.87 -56.65 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -41.95 -40.61 2.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.871 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.09 -57.18 3.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.894 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.7 tmm? -48.96 -60.56 2.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 96.6 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 11.3 mttp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.715 0.293 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.583 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.7 mpt_? -121.59 42.98 2.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -116.58 151.4 36.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 37.3 tp -58.73 125.99 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.874 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 14.7 t -65.06 146.25 55.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -79.91 -10.64 59.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.88 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -104.1 -46.14 4.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 455' ' ' HIS . 21.9 t80 -47.43 -36.33 9.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.889 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.1 mt -42.95 -37.68 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.114 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 70.8 p -101.6 -36.69 8.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.138 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.46 -4.76 17.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 10.6 t80 -99.63 71.33 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 110.853 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.77 105.31 15.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -61.27 0.88 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.104 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -83.44 109.48 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.871 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.74 -78.58 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.125 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -81.34 -1.21 44.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -99.4 0.07 41.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 10.3 t -80.08 111.11 19.31 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.627 0.727 . . . . 0.0 110.885 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.7 Cg_endo -69.8 3.83 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.7 2.267 . . . . 0.0 112.336 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -99.87 179.99 4.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.0 mmm -95.16 140.54 29.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.823 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 440' ' ' TYR . 18.8 m170 -119.19 -76.11 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.37 -65.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.464 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.451 ' C ' ' O ' ' A' ' 456' ' ' GLY . 29.0 m-20 -33.93 -43.69 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.862 0.363 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 18.6 t80 -43.19 128.48 3.46 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.598 0.713 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 149.25 66.7 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.645 2.23 . . . . 0.0 112.399 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.467 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 9.2 t -74.28 150.3 40.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.89 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 465' ' ' THR . 16.3 ttmt -80.75 -69.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.1 mt -43.77 -60.3 1.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . 0.412 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 86.3 t80 -39.29 -25.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 13.6 m-70 -99.48 -51.67 3.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 464' ' ' HIS . 54.2 p -33.78 -38.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.0 p -131.29 -36.71 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.156 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . 0.412 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 140.3 -39.07 1.52 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.483 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . 0.438 ' CG ' ' N ' ' A' ' 469' ' ' CYS . 21.2 t-20 -107.79 168.18 9.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . 0.438 ' N ' ' CG ' ' A' ' 468' ' ' ASN . 17.7 t -120.9 150.3 41.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.3 tp -76.02 -36.49 31.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.112 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -52.6 -61.79 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 138.61 -156.64 24.26 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.99 -39.63 87.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.755 0.312 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.67 63.71 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -79.06 144.47 34.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.89 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 3.9 ppp? -55.71 -24.2 33.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.875 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 33.5 m-85 -104.28 160.14 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.884 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.4 m -80.04 145.87 32.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.898 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -111.55 22.58 14.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . 0.407 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 71.1 m-20 -58.41 156.35 22.81 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.627 0.727 . . . . 0.0 110.83 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.4 Cg_endo -69.74 112.1 2.99 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.716 2.278 . . . . 0.0 112.358 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 18.2 mt -39.72 129.37 2.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.93 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 7.2 p -102.63 -179.94 4.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.11 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . 0.431 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 0.2 OUTLIER -70.41 -30.83 67.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.431 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 12.7 pt-20 -79.0 -42.33 26.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.917 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.9 p -68.57 -50.85 48.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.132 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.0 OUTLIER -39.38 -31.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.12 -41.38 74.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 434' ' ' ARG . 49.9 mt -53.56 -66.06 0.46 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 91.8 mt -39.93 -56.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -39.69 -41.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.7 tppp? -80.09 -42.76 22.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -59.6 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 58.7 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 452' ' ' PRO . 56.2 mttt . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.728 0.299 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.668 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.8 tpp85 -89.15 63.75 6.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -139.17 144.08 38.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.854 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 35.6 tp -61.95 132.5 53.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . 0.446 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 7.0 t -67.06 137.79 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -77.48 -7.28 55.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.91 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -109.54 -44.12 3.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.46 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 39.2 t80 -48.13 -34.66 10.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.905 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 63.5 mt -43.48 -32.9 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.129 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 p -99.51 -33.8 10.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.139 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.01 -10.58 13.58 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.501 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -100.43 98.99 9.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.865 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 37.6 t -136.42 109.47 7.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.51 -59.31 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 7.8 mtm105 -80.49 107.16 13.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.18 -77.61 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -82.43 -10.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -99.45 15.61 25.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.891 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 35.8 t -80.42 111.72 25.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.1 Cg_endo -69.75 3.21 2.9 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.64 2.227 . . . . 0.0 112.368 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -105.35 -175.11 2.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 40.3 mmm -100.74 136.52 40.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.899 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.46 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 24.8 m170 -118.13 -75.24 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.74 -65.3 1.78 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.516 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 456' ' ' GLY . 8.3 m-20 -33.44 -47.26 0.21 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.826 0.346 . . . . 0.0 110.847 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 17.2 t80 -43.46 130.3 3.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.64 0.734 . . . . 0.0 110.845 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 146.25 59.34 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.685 2.257 . . . . 0.0 112.345 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.533 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 45.4 t -70.19 146.14 50.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.885 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -79.64 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 464' ' ' HIS . 35.2 mt -45.41 -59.77 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.958 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -40.91 -22.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 28.5 m-70 -100.19 -54.96 2.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.47 ' C ' ' O ' ' A' ' 464' ' ' HIS . 71.8 p -31.17 -41.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.136 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.408 ' N ' ' O ' ' A' ' 464' ' ' HIS . 77.8 p -128.75 -36.78 1.8 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.114 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 137.9 -38.07 1.75 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.476 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -106.72 174.32 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.866 0.365 . . . . 0.0 110.852 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.8 t -133.17 128.7 36.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.4 tp -72.11 -26.63 25.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -49.59 -43.52 46.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.15 -169.59 23.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.6 -29.48 51.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.773 0.321 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -100.67 44.33 1.02 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 47.7 t -51.17 144.27 9.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.513 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 5.1 ppp? -65.42 -17.35 64.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.513 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 17.8 m-85 -102.81 159.44 15.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 29.1 m -80.13 132.41 35.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -100.8 23.5 10.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.77 159.51 52.94 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.612 0.72 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 110.79 2.65 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.671 2.247 . . . . 0.0 112.332 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.48 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 24.9 mt -40.16 131.5 2.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . 0.564 ' OG1' HG23 ' A' ' 486' ' ' THR . 24.8 p -99.59 169.63 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.14 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -56.2 -30.98 63.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -81.41 -55.47 4.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.575 ' HA ' HD12 ' A' ' 489' ' ' LEU . 47.6 p -55.32 -37.95 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.119 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 487' ' ' ARG . 0.0 OUTLIER -52.3 -41.84 63.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -65.28 -33.39 75.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.668 HD22 ' O ' ' A' ' 434' ' ' ARG . 62.9 mt -59.39 -65.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 493' ' ' MET . 40.6 mt -40.13 -61.57 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -39.95 -41.91 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -79.94 -31.02 40.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . 0.467 ' N ' ' O ' ' A' ' 490' ' ' LEU . 14.0 tmm? -63.32 -59.4 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.4 mp . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.886 -179.964 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.778 0.323 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . 0.476 ' HB2' ' CD2' ' A' ' 489' ' ' LEU . 0.0 OUTLIER -83.08 35.12 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -115.37 154.59 28.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . 0.502 HD13 ' CD2' ' A' ' 458' ' ' PHE . 52.4 tp -65.04 117.78 8.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.921 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . 0.468 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.1 t -50.66 116.99 2.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -60.23 -11.51 6.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -100.54 -48.68 4.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.49 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 42.3 t80 -47.09 -36.55 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 64.6 mt -40.05 -35.31 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.157 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 20.2 p -100.4 -33.45 10.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.56 -8.68 15.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.508 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.01 94.1 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 4.5 t -132.68 106.91 8.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.21 -67.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 25.0 mtm-85 -67.07 101.62 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.51 -75.11 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.072 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -81.34 -6.62 59.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -112.6 23.54 13.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.0 t -73.95 114.77 35.93 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.609 0.719 . . . . 0.0 110.925 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -5.92 17.36 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.68 2.254 . . . . 0.0 112.358 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -106.59 -173.54 2.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.1 mmm -99.63 148.55 24.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.916 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . 0.49 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 23.9 m170 -126.3 -76.68 0.58 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.837 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' N ' ' A' ' 458' ' ' PHE . . . -80.91 -65.28 1.72 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.475 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.2 m-20 -33.98 -35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . 0.502 ' CD2' HD13 ' A' ' 436' ' ' LEU . 16.3 t80 -56.79 124.9 66.57 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.665 0.745 . . . . 0.0 110.836 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 135.08 29.66 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 2.271 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 7.4 t -57.68 147.74 26.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.837 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -80.27 -68.16 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 464' ' ' HIS . 25.6 mt -45.52 -58.19 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.929 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -41.22 -23.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.557 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.4 m-70 -99.91 -51.41 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 80.8 p -33.11 -48.14 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 50.5 p -123.36 -32.32 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.167 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.22 -38.57 1.84 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.479 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -105.58 156.96 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.889 0.376 . . . . 0.0 110.873 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 11.4 t -117.3 130.82 56.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.872 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.8 tp -57.21 -29.3 31.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.143 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -56.75 -63.53 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.23 -148.26 19.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.501 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -76.31 -38.44 56.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.803 0.335 . . . . 0.0 110.827 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -100.4 63.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 51.9 t -78.86 147.61 33.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.4 ppp? -59.43 -23.59 62.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 25.0 m-85 -103.53 161.29 14.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 59.2 m -80.24 141.07 35.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.833 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 47.3 m170 -108.89 29.34 7.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.34 152.86 93.78 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.642 0.734 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.81 116.37 4.53 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 0.0 112.33 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.557 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 40.2 mt -40.06 147.54 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.2 p -129.74 155.46 45.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.11 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 3.5 pm0 -39.38 -31.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . 0.401 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 6.0 tm-20 -80.36 -73.99 0.33 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.689 ' HA ' HD12 ' A' ' 489' ' ' LEU . 15.7 p -47.61 -49.61 26.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.151 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -43.5 1.39 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -59.71 -41.82 91.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 486' ' ' THR . 31.5 mt -51.08 -64.79 0.7 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . 0.515 ' CD1' HD21 ' A' ' 482' ' ' LEU . 44.6 mt -40.62 -59.45 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -39.08 -37.31 0.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -38.91 30.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.925 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . 0.437 ' N ' ' O ' ' A' ' 490' ' ' LEU . 12.1 tmm? -62.8 -58.75 6.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.825 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.92 -179.997 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 433' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 17.0 mttm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.786 0.327 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 38.5 mmm-85 -109.17 39.49 2.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -112.25 151.09 30.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.77 124.12 20.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 37.8 t -67.75 139.47 56.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.455 ' HA ' HD12 ' A' ' 441' ' ' ILE . 2.7 mtmp? -79.57 4.75 14.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -109.12 -53.61 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.878 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' TYR . . . . . 0.463 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 22.1 t80 -46.89 -39.99 13.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 438' ' ' LYS . 53.4 mt -40.54 -37.98 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.097 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.7 p -101.7 -35.94 8.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.156 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.02 -9.96 13.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -99.06 87.62 3.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.892 0.377 . . . . 0.0 110.886 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.4 t -125.01 103.6 8.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.71 -59.08 1.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.174 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.7 mtt180 -81.98 107.52 14.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -79.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -82.6 8.5 11.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -108.34 -12.67 15.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 14.6 t -65.77 111.26 5.92 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.615 0.722 . . . . 0.0 110.893 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 452' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.6 Cg_endo -69.79 2.99 3.05 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.64 2.227 . . . . 0.0 112.342 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 453' ' ' TYR . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 80.3 m-85 -100.1 176.1 5.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 32.1 mmm -91.86 140.66 29.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.866 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -117.81 -77.25 0.57 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.464 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.84 -66.98 1.58 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' A' ' 456' ' ' GLY . 25.2 m-20 -32.58 -43.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.52 130.31 6.33 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.626 0.727 . . . . 0.0 110.85 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 144.3 53.79 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 0.0 112.322 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' CYS . . . . . 0.492 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 20.1 t -65.71 141.95 58.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 465' ' ' THR . 72.3 tttt -75.91 -66.74 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.0 mt -44.67 -58.64 2.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -39.37 -25.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' HIS . . . . . 0.54 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 48.2 m-70 -100.58 -53.14 3.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' THR . . . . . 0.474 ' C ' ' O ' ' A' ' 464' ' ' HIS . 56.0 p -31.38 -42.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.149 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 46.5 p -129.49 -32.92 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.149 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.95 -41.35 1.5 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.49 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -103.72 150.47 24.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.922 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 471' ' ' ASN . 53.3 t -110.69 99.9 8.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.87 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' ILE . . . . . 0.66 HG23 ' O ' ' A' ' 470' ' ' ILE . 8.1 tp -80.51 38.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 469' ' ' CYS . 30.2 m-20 -95.76 -54.73 3.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 170.11 154.32 9.3 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -47.42 -47.54 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.819 0.342 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -100.92 55.53 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -42.06 152.51 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' MET . . . . . 0.473 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 4.2 ppp? -77.31 -18.39 57.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.855 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.473 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.7 m-85 -105.72 158.93 16.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.862 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 67.5 m -80.1 144.81 32.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.852 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -108.12 31.87 5.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.75 158.07 81.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.602 0.715 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 134.49 28.12 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.688 2.259 . . . . 0.0 112.377 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.54 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 44.7 mt -62.13 137.03 58.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 69.1 p -119.9 152.55 37.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.125 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -40.03 -29.23 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.71 -75.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.838 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.45 ' O ' ' N ' ' A' ' 489' ' ' LEU . 48.6 p -46.9 -47.96 21.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.116 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' ARG . . . . . 0.412 ' HD3' HD13 ' A' ' 482' ' ' LEU . 4.4 tpt180 -40.34 -41.09 1.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -64.18 -39.27 93.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.946 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 486' ' ' THR . 79.1 mt -48.08 -67.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.87 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 60.7 mt -41.26 -57.18 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -39.96 -42.44 1.36 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.88 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -79.79 -44.61 20.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.882 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.4 tmm? -54.89 -59.29 4.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.869 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.9 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 -179.934 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 32.6 p -125.47 -44.56 1.84 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.904 0.383 . . . . 0.0 110.888 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 51.3 p -66.22 -62.39 1.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.86 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 80.55 -46.09 3.21 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.515 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 18.1 t -58.93 156.27 11.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.853 0.359 . . . . 0.0 110.846 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . 0.404 ' O ' ' C ' ' A' ' 428' ' ' GLY . 52.9 p -146.49 111.28 5.27 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.822 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 427' ' ' SER . . . -36.23 141.12 0.21 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.499 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -79.26 106.41 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 3.6 mp -138.77 160.08 64.62 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.638 0.732 . . . . 0.0 110.913 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 80.38 0.9 Allowed 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.655 2.236 . . . . 0.0 112.306 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 30.6 mmtm -146.66 125.01 12.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.936 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 18.4 mmtp -84.6 120.18 26.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.897 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.403 ' O ' HD22 ' A' ' 489' ' ' LEU . 0.0 OUTLIER -100.15 43.01 1.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.86 -180.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 436' ' ' LEU . 51.3 tp10 -114.52 162.54 16.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.916 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.454 ' N ' ' HG3' ' A' ' 435' ' ' GLU . 26.4 tp -74.65 104.72 5.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 34.9 t -42.41 135.3 2.74 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.888 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.477 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -71.1 -5.6 32.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.925 179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -105.48 -49.4 3.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.555 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 40.6 t80 -43.27 -35.42 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.945 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -44.11 -39.1 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 58.6 p -100.32 -37.78 8.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.149 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.04 -4.52 18.57 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.494 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . 0.476 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -99.54 77.65 2.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.862 0.363 . . . . 0.0 110.886 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.23 107.37 15.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.888 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.41 -59.0 1.41 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.102 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -84.77 111.12 19.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.14 -76.85 0.23 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.062 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -81.56 -5.21 57.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.869 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 -99.4 6.83 45.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.869 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 44.8 t -80.09 111.41 21.79 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.645 0.736 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 1.5 4.34 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.692 2.261 . . . . 0.0 112.365 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 55.6 m-85 -102.05 179.6 4.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 18.9 mmm -95.48 143.32 26.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.93 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.555 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 21.9 m170 -120.51 -77.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.18 -63.2 1.9 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.52 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 7.8 m-20 -34.0 -46.65 0.24 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.789 0.328 . . . . 0.0 110.83 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -43.17 129.36 3.42 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.591 0.71 . . . . 0.0 110.907 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 146.03 59.04 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.665 2.243 . . . . 0.0 112.355 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 14.3 t -69.01 145.28 53.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.88 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.406 ' O ' HG23 ' A' ' 465' ' ' THR . 29.4 tttp -80.09 -65.6 0.98 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.867 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.1 mt -44.73 -58.64 2.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 91.0 t80 -39.61 -25.09 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.948 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.49 ' N ' ' O ' ' A' ' 462' ' ' LEU . 43.8 m-70 -100.29 -52.46 3.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.855 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.472 ' C ' ' O ' ' A' ' 464' ' ' HIS . 70.7 p -31.61 -45.31 0.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.15 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 76.7 p -126.01 -34.66 2.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.19 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.89 -37.69 1.98 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.499 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -108.58 140.73 41.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.916 0.389 . . . . 0.0 110.866 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 49.3 t -100.55 135.18 42.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.866 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.438 HG23 ' N ' ' A' ' 471' ' ' ASN . 5.6 tp -61.2 -42.03 91.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.156 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . 0.438 ' N ' HG23 ' A' ' 470' ' ' ILE . 31.6 m-20 -51.84 -57.48 9.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.869 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 116.12 -149.0 18.88 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -75.76 -16.03 60.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.808 0.337 . . . . 0.0 110.866 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.18 44.41 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.832 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 t -79.48 147.96 32.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.89 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.572 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.3 ppp? -76.14 -11.15 59.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.572 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.3 m-85 -107.96 160.19 15.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.834 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 74.8 m -77.77 143.48 37.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.809 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 26.0 m170 -114.73 31.79 6.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.841 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -72.87 159.43 85.34 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.606 0.717 . . . . 0.0 110.865 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 120.86 7.58 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.687 2.258 . . . . 0.0 112.37 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.427 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 27.1 mt -42.99 148.51 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.894 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 24.7 p -131.11 154.77 47.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.156 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -39.95 -31.32 0.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.887 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -80.01 -74.13 0.32 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.887 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 70.1 p -42.83 -46.33 5.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.18 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.16 -46.5 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -55.9 -38.33 70.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.837 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 434' ' ' ARG . 34.7 mt -53.03 -65.86 0.49 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.921 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 84.3 mt -40.64 -56.6 2.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -39.95 -43.36 1.51 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.15 -59.94 2.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -41.41 -59.4 1.58 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.868 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.81 -62.1 1.97 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -40.47 -45.07 2.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -62.27 -58.52 7.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.87 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -61.47 -64.81 0.82 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.861 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -39.41 -62.81 0.62 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.106 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 18.1 tp10 -52.04 -54.03 34.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.866 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -87.59 89.45 8.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.11 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -112.47 141.0 16.59 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.436 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -112.51 146.46 38.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.741 0.305 . . . . 0.0 111.118 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -77.31 143.62 38.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.883 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -143.53 127.25 17.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.839 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 20.4 pt-20 -49.04 160.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.86 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -165.94 154.08 10.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -167.9 174.63 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.897 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 96.3 t -104.28 102.5 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.131 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -49.6 145.22 5.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -73.27 131.04 41.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.854 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 13.7 mt -70.31 -43.88 69.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.925 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -169.33 107.58 0.41 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.861 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -82.52 147.01 28.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.924 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 86.6 p -54.58 143.73 23.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.847 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -130.37 152.93 19.94 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.482 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.69 -173.46 0.71 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.688 2.258 . . . . 0.0 112.351 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.2 t -116.83 160.66 20.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.829 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.68 133.26 30.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.855 -179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 CA-C-O 119.072 -0.849 . . . . 0.0 112.523 179.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . 0.436 ' O ' ' C ' ' A' ' 423' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 422' ' ' GLY . 28.4 t -34.88 136.89 0.14 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.857 0.361 . . . . 0.0 110.825 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 2.7 t -108.31 150.6 27.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 -179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -83.34 -170.81 46.77 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.506 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 14.5 m -150.65 122.92 8.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.877 0.37 . . . . 0.0 110.799 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 1.9 t -98.78 -38.32 9.11 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.855 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . 0.421 ' O ' HD12 ' A' ' 430' ' ' LEU . . . 42.53 -111.75 0.38 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.507 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -49.33 146.06 4.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.9 0.381 . . . . 0.0 110.876 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.421 HD12 ' O ' ' A' ' 428' ' ' GLY . 5.0 mp -114.14 144.46 31.67 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.562 0.696 . . . . 0.0 110.939 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.77 -91.08 0.01 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.707 2.272 . . . . 0.0 112.368 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -103.97 163.25 12.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.892 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.464 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 24.2 mttm -72.22 163.09 28.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.916 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.526 ' HB3' HD23 ' A' ' 489' ' ' LEU . 0.2 OUTLIER -120.53 48.34 1.62 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.877 179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -139.47 154.66 47.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 -179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.524 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 14.5 tp -70.16 143.26 52.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.9 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 22.6 t -74.11 146.69 43.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.892 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.484 ' N ' ' HE2' ' A' ' 438' ' ' LYS . 0.2 OUTLIER -77.35 -12.5 59.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.912 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -104.49 -48.36 3.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.504 ' CE1' ' HB3' ' A' ' 455' ' ' HIS . 37.7 t80 -42.94 -36.38 1.52 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.941 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . 0.474 HG12 HD21 ' A' ' 436' ' ' LEU . 79.2 mt -40.1 -36.54 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.12 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.76 -34.68 10.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.093 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.96 -9.03 21.25 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.523 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -98.86 81.93 2.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.821 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.1 t -118.26 100.32 7.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.9 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.06 -59.61 1.43 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.103 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 79.1 mtt180 -74.46 96.19 2.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.861 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.18 -76.34 0.23 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.145 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -81.56 20.3 0.92 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -124.98 -1.32 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.2 t -80.16 111.24 20.48 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.644 0.735 . . . . 0.0 110.925 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 0.26 5.88 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.664 2.243 . . . . 0.0 112.348 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.464 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 78.5 m-85 -100.01 175.69 5.67 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 48.8 mmm -90.09 143.34 26.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.898 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.504 ' HB3' ' CE1' ' A' ' 440' ' ' TYR . 22.2 m170 -120.03 -75.85 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.28 -68.15 1.5 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.467 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.452 ' C ' ' O ' ' A' ' 456' ' ' GLY . 5.9 m-20 -34.5 -35.53 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.844 0.354 . . . . 0.0 110.862 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.524 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 20.7 t80 -51.81 124.05 26.45 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.663 0.744 . . . . 0.0 110.856 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 140.99 43.87 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.721 2.281 . . . . 0.0 112.291 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 7.0 t -68.36 142.12 55.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.415 ' O ' HG23 ' A' ' 465' ' ' THR . 78.6 tttt -76.81 -65.59 0.92 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.885 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.481 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.9 mt -44.99 -58.25 3.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -40.72 -23.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.948 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.564 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.9 m-70 -100.37 -51.49 3.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.878 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.464 ' C ' ' O ' ' A' ' 464' ' ' HIS . 49.0 p -31.37 -40.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.167 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.426 ' N ' ' O ' ' A' ' 464' ' ' HIS . 75.6 p -132.93 -32.75 1.21 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.182 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.53 -34.81 2.3 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.475 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -110.0 149.21 30.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.846 0.355 . . . . 0.0 110.898 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 15.0 t -104.24 151.43 23.4 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.884 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.1 tp -79.33 -37.13 18.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.112 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -49.89 -65.94 0.48 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 139.67 -169.39 24.64 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.527 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -63.19 -24.54 67.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.834 0.35 . . . . 0.0 110.856 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -104.9 46.92 0.89 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.815 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 50.0 t -71.75 147.62 47.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.879 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.528 ' SD ' ' CE1' ' A' ' 477' ' ' PHE . 5.2 ppp? -79.67 11.74 2.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.851 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.528 ' CE1' ' SD ' ' A' ' 476' ' ' MET . 14.0 m-85 -123.07 155.71 36.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 8.0 m -75.36 127.09 32.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 -179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -103.03 16.12 27.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.894 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -64.03 156.44 74.18 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.647 0.737 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 121.26 7.94 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.687 2.258 . . . . 0.0 112.342 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.564 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 59.3 mt -41.49 144.94 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.921 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 485' ' ' GLU . 4.4 p -138.11 158.12 44.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.162 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -38.69 -29.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.868 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.433 ' N ' ' O ' ' A' ' 483' ' ' THR . 32.4 mt-10 -81.24 -75.77 0.27 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 489' ' ' LEU . 68.1 p -50.03 -47.52 53.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.139 -179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.09 -36.5 0.31 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.89 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -65.21 -41.61 94.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.909 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.526 HD23 ' HB3' ' A' ' 434' ' ' ARG . 87.8 mt -46.9 -62.61 1.32 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.921 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 66.4 mt -40.32 -57.12 1.83 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -42.54 -38.24 1.9 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.853 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.98 -52.37 8.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.854 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 8.6 tmm? -56.5 -60.83 2.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.875 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 8.0 mp -49.84 -47.43 51.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.932 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.05 -45.08 31.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.128 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -53.63 -47.58 70.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.4 ' O ' ' C ' ' A' ' 498' ' ' ALA . 26.3 t0 -73.04 -68.09 0.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -37.56 -41.77 0.49 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.087 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -52.26 -60.7 2.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.892 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -42.79 -48.72 5.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.067 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 123.58 121.85 2.67 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.482 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -139.24 117.53 11.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.763 0.316 . . . . 0.0 111.115 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 31.5 tp10 -104.58 86.76 2.56 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.813 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -127.94 92.6 3.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.871 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -108.84 147.36 32.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 -179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 34.6 mmtm -109.27 174.55 5.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -122.15 144.66 48.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.895 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 99.8 t -99.2 114.97 38.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.156 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -96.19 112.91 24.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.889 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -55.16 147.56 16.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.892 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 512' ' ' LYS . 14.9 mt -97.72 78.26 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.941 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.446 ' C ' ' O ' ' A' ' 511' ' ' LEU . 63.7 mttt 34.95 41.92 0.07 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.883 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.25 147.36 0.55 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.951 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 2.4 m -172.71 159.21 4.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -116.88 64.04 0.36 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.504 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.81 173.23 11.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.69 2.26 . . . . 0.0 112.376 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.5 m -169.32 128.62 1.02 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.834 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 19.1 m -131.43 163.51 27.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.85 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.477 -179.984 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.509 -0.237 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 18.8 m -39.57 117.65 0.75 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.896 0.379 . . . . 0.0 110.825 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 29.8 p -150.31 166.1 31.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.823 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 139.19 96.45 0.34 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.486 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 43.6 t -58.68 154.83 13.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.901 0.381 . . . . 0.0 110.811 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 19.7 m -156.88 146.96 21.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.86 -179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -165.51 129.06 1.88 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -87.86 145.62 25.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.871 0.367 . . . . 0.0 110.914 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 9.0 mt -137.21 151.46 71.73 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.604 0.716 . . . . 0.0 110.898 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -2.43 10.17 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.653 2.235 . . . . 0.0 112.304 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 24.8 mmtm -111.09 158.24 19.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.882 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -131.09 131.48 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.918 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.45 ' HB3' HD22 ' A' ' 489' ' ' LEU . 7.6 mpt_? -105.53 44.67 1.02 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -113.71 152.17 30.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.897 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 37.4 tp -63.12 114.63 3.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.976 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.71 131.99 52.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.91 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.82 15.47 1.76 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.937 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -120.41 -37.11 3.09 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.438 ' CZ ' ' HE2' ' A' ' 476' ' ' MET . 34.9 t80 -68.09 -35.9 78.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.88 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.0 mt -43.19 -33.07 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.146 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.5 p -102.08 -36.47 8.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.124 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 120.09 -10.15 11.05 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.473 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . 0.418 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 8.2 t80 -99.65 85.86 3.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.871 0.367 . . . . 0.0 110.913 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.1 t -121.16 110.49 16.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -41.56 -70.2 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.095 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -78.59 107.73 11.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.844 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -75.32 0.26 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.7 2.99 23.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -114.35 15.78 17.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.413 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 36.8 t -80.59 111.2 20.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.646 0.736 . . . . 0.0 110.864 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.6 Cg_endo -69.7 -0.88 7.5 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.694 2.263 . . . . 0.0 112.367 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -101.88 179.76 4.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 34.4 mmm -99.98 139.29 35.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.43 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 26.2 m170 -113.17 -78.34 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.848 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -81.13 -63.12 1.91 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.507 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.466 ' C ' ' O ' ' A' ' 456' ' ' GLY . 42.6 t0 -32.71 -45.71 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.828 0.346 . . . . 0.0 110.926 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -46.91 124.59 8.15 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.608 0.718 . . . . 0.0 110.892 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 145.95 58.82 Favored 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.704 2.269 . . . . 0.0 112.333 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.475 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.5 t -64.48 144.41 57.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.843 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.457 ' O ' HG23 ' A' ' 465' ' ' THR . 24.2 ttpt -79.33 -67.15 0.78 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.9 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.479 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.1 mt -44.63 -59.17 2.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -39.67 -25.03 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.549 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 34.8 m-70 -99.89 -51.72 3.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.457 HG23 ' O ' ' A' ' 461' ' ' LYS . 44.5 p -35.58 -44.38 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.195 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 68.3 p -123.35 -35.03 3.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.37 -37.65 1.96 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.489 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -109.96 147.74 32.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.86 0.362 . . . . 0.0 110.855 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 38.2 t -103.2 147.56 26.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.879 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.443 HG23 ' N ' ' A' ' 471' ' ' ASN . 4.5 tp -70.6 -42.36 77.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.129 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . 0.443 ' N ' HG23 ' A' ' 470' ' ' ILE . 8.0 t-20 -51.91 -54.71 26.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 121.63 -153.24 16.73 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.434 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.44 -19.15 59.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.773 0.321 . . . . 0.0 110.857 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -101.41 42.7 1.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.95 143.61 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.91 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.438 ' HE2' ' CZ ' ' A' ' 440' ' ' TYR . 5.3 ppp? -80.93 19.32 0.88 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.415 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 26.3 m-85 -126.38 158.61 35.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.882 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 13.2 m -76.47 120.29 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -100.84 32.66 3.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.821 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -77.71 161.51 71.45 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.588 0.709 . . . . 0.0 110.88 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 116.93 4.79 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.712 2.275 . . . . 0.0 112.311 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.624 HD13 ' HG2' ' A' ' 487' ' ' ARG . 28.6 mt -40.98 150.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.93 179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.2 p -133.27 154.92 50.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.154 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -40.48 -33.26 0.25 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.855 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -80.16 -74.69 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.521 ' HA ' HD12 ' A' ' 489' ' ' LEU . 32.1 p -46.95 -52.98 13.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.134 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.624 ' HG2' HD13 ' A' ' 482' ' ' LEU . 0.0 OUTLIER -40.96 -44.55 2.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.911 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -59.64 -38.29 80.98 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.865 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.521 HD12 ' HA ' ' A' ' 486' ' ' THR . 55.0 mt -52.21 -65.54 0.54 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.936 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 78.1 mt -42.25 -57.59 2.49 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.905 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -39.89 -42.31 1.31 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -79.53 -48.32 14.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.913 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 17.0 tmm? -51.5 -58.76 5.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.913 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 97.2 mt -40.98 -47.95 3.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.925 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.67 -43.36 93.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.099 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -60.26 -43.73 95.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -63.31 -63.96 1.04 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.84 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -50.18 -56.27 11.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.102 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -49.0 -57.95 5.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.902 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.37 -52.36 28.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.072 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 99.04 -83.49 0.61 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.426 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -135.67 175.35 9.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.766 0.317 . . . . 0.0 111.085 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -56.38 146.38 24.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.907 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -140.69 155.67 46.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.827 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -64.0 129.39 39.86 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? -119.99 -45.77 2.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.888 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -129.42 92.08 3.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.869 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.65 13.95 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.123 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -140.15 134.09 30.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -96.89 166.64 11.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.884 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.555 HD12 ' N ' ' A' ' 512' ' ' LYS . 4.1 pp -122.95 -42.18 2.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.91 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.555 ' N ' HD12 ' A' ' 511' ' ' LEU . 38.2 pttt -85.04 43.37 1.0 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.882 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.22 105.05 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.965 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 47.8 t -76.71 129.39 36.27 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 -179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -133.78 -163.18 10.29 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.505 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 163.9 36.6 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 0.0 112.332 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 56.5 p -126.78 38.0 4.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.88 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 87.6 p -58.46 170.67 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.827 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 CA-C-O 119.118 -0.823 . . . . 0.0 112.514 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 2.3 m -112.2 131.19 55.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.891 0.377 . . . . 0.0 110.885 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 34.9 p -58.28 175.32 0.23 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.831 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -128.45 166.58 20.94 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.505 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 59.2 p -132.31 153.58 50.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 110.852 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 71.3 m -97.35 -58.05 2.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.84 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 48.98 69.2 1.05 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.49 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -108.68 138.97 44.14 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.847 0.356 . . . . 0.0 110.905 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.7 mp -111.47 156.8 40.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.591 0.71 . . . . 0.0 110.958 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.65 2.57 3.35 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.724 2.282 . . . . 0.0 112.35 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -94.0 128.66 40.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 5.2 mtpp -85.97 152.02 23.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.864 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -123.62 46.21 2.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.892 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -114.45 165.72 12.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.909 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.562 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 27.2 tp -71.71 115.92 11.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.949 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.54 125.22 22.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.898 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -66.26 -3.76 6.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.913 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -100.08 -55.36 2.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.559 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 10.2 t80 -43.91 -36.36 2.38 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 39.5 mt -43.74 -38.44 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.074 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -99.83 -35.02 9.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.53 -9.78 11.64 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.471 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -99.73 96.16 7.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.891 0.377 . . . . 0.0 110.881 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 36.5 t -130.64 102.16 6.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.873 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.095 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -67.69 82.71 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.848 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -78.73 -57.47 3.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.058 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.88 -2.03 31.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.956 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 36.0 m-20 -134.85 37.49 3.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.909 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.401 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 53.2 t -80.76 111.04 19.87 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.603 0.716 . . . . 0.0 110.896 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.4 Cg_endo -69.71 -2.5 10.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.712 2.275 . . . . 0.0 112.342 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 66.2 m-85 -108.31 -177.24 3.27 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.893 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 38.3 mmm -100.26 147.78 25.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.898 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.559 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 23.4 m170 -122.57 -77.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.864 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.438 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.68 -65.73 1.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.488 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.438 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.4 m-20 -34.73 -39.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.842 0.353 . . . . 0.0 110.911 -179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.562 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 18.7 t80 -50.44 124.59 18.96 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.657 0.741 . . . . 0.0 110.826 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 141.08 44.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.339 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.0 t -65.9 141.07 58.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.876 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -78.01 -66.8 0.8 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.884 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.1 mt -45.37 -56.67 4.71 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.917 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -40.81 -24.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.502 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 40.9 m-70 -100.61 -53.66 3.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.862 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.485 ' C ' ' O ' ' A' ' 464' ' ' HIS . 69.8 p -31.1 -41.33 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.15 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.431 ' N ' ' O ' ' A' ' 464' ' ' HIS . 39.2 p -129.81 -36.72 1.58 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.139 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 136.22 -37.85 1.84 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -106.66 142.74 35.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 42.1 t -100.51 144.45 29.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.6 tp -71.9 -36.57 58.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.149 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -52.21 -60.03 3.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.921 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 125.72 -156.01 19.26 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.512 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -71.97 -27.59 62.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.806 0.336 . . . . 0.0 110.89 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -101.47 44.47 1.01 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -73.91 146.48 43.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.845 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.1 ppp? -80.6 17.52 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.925 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 25.4 m-85 -128.23 154.81 45.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.9 m -78.55 126.9 31.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.853 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -100.11 19.2 16.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.86 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 96.3 m-20 -61.28 155.14 58.89 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.596 0.712 . . . . 0.0 110.889 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 116.17 4.43 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.74 2.293 . . . . 0.0 112.324 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.623 HD11 ' CD1' ' A' ' 490' ' ' LEU . 12.7 mt -40.61 132.41 2.16 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.924 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.52 ' O ' ' CB ' ' A' ' 487' ' ' ARG . 69.2 p -112.71 167.13 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.146 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -49.61 -31.86 11.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.867 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -81.26 -77.0 0.22 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.885 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 49.9 p -45.62 -36.94 5.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.152 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.52 ' CB ' ' O ' ' A' ' 483' ' ' THR . 12.5 tpt180 -48.71 -40.92 30.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.859 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -61.45 -45.76 92.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.859 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 45.1 mt -41.41 -67.01 0.28 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.897 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.623 ' CD1' HD11 ' A' ' 482' ' ' LEU . 77.4 mt -40.78 -59.41 1.41 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.919 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -39.7 -41.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.87 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 2.2 tppp? -79.63 -50.58 10.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.3 tmm? -57.93 -62.73 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.413 ' O ' ' C ' ' A' ' 495' ' ' ALA . 80.7 mt -45.27 -73.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.926 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' A' ' 494' ' ' LEU . . . -36.36 -46.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.096 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -58.7 -53.02 63.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.406 ' O ' ' C ' ' A' ' 498' ' ' ALA . 4.9 t0 -64.1 -65.87 0.62 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.88 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.463 ' O ' ' N ' ' A' ' 501' ' ' GLY . . . -37.47 -64.98 0.34 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 498' ' ' ALA . 10.4 tm-20 -36.08 -53.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.865 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -84.3 40.64 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 498' ' ' ALA . . . 139.96 100.92 0.47 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.494 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -161.18 126.06 3.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.737 0.303 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.66 87.18 2.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -87.12 171.17 10.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.837 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . 0.426 ' O ' ' C ' ' A' ' 506' ' ' LYS . 11.1 tp10 -129.52 143.38 50.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.87 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 505' ' ' GLU . 6.3 ptpp? -34.9 148.01 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 55.4 tt0 -85.5 159.65 19.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.915 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 508' ' ' VAL . 9.1 p -117.85 113.74 43.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.114 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -101.39 177.63 4.87 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -84.94 -75.5 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.919 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.3 mp 46.34 33.97 2.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.928 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 46.5 mmtt -131.94 10.64 4.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.917 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 49.8 tttt -56.73 132.23 51.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.917 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 25.4 m -150.72 176.97 10.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -177.49 83.56 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.457 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 -179.08 2.66 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.696 2.264 . . . . 0.0 112.324 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 80.2 p -126.07 175.55 7.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.841 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 40.6 m -117.1 -57.22 2.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.865 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 CA-C-O 119.18 -0.789 . . . . 0.0 112.498 -179.967 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 16.3 m -138.6 142.98 39.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 110.821 -179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 7.4 t -166.65 110.06 0.74 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.844 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 160.19 51.21 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 81.3 p -84.79 137.21 33.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.885 0.374 . . . . 0.0 110.887 -179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 79.3 p -57.88 -45.55 86.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.877 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 172.77 178.88 43.14 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.513 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -125.39 97.09 5.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.902 0.382 . . . . 0.0 110.903 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -89.04 153.86 49.35 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.597 0.713 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 82.5 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.676 2.251 . . . . 0.0 112.371 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -144.87 163.78 33.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.5 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 3.7 mmmp? -88.55 -36.73 16.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.901 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 489' ' ' LEU . 5.7 tpt180 61.01 40.98 14.57 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -135.12 160.86 37.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.561 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 43.6 tp -60.75 112.92 2.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . 0.5 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 5.9 t -53.24 115.49 1.92 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.867 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -56.03 -12.18 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -101.0 -48.46 4.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.5 ' CB ' ' HB3' ' A' ' 437' ' ' CYS . 25.1 t80 -45.38 -40.75 8.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.917 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 54.1 mt -39.95 -31.82 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.116 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 81.7 p -102.15 -36.6 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.44 11.68 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.487 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -96.96 88.53 4.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.907 0.384 . . . . 0.0 110.848 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 12.6 t -126.37 110.49 13.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.76 -72.05 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.067 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 64.5 mtt180 -73.63 102.41 3.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.93 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.1 -72.14 0.44 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.112 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -76.43 -7.33 54.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.892 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -118.93 30.26 7.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.892 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 44.7 t -73.97 113.39 22.78 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.624 0.725 . . . . 0.0 110.865 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 54.3 Cg_endo -69.77 7.11 1.07 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.689 2.26 . . . . 0.0 112.361 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.5 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 49.3 m-85 -118.38 -175.23 2.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.904 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 27.4 mmm -101.15 134.85 43.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.88 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.425 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.5 m170 -113.58 -76.66 0.58 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.829 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.499 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -77.97 -70.64 1.29 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.499 ' C ' ' O ' ' A' ' 456' ' ' GLY . 2.6 m-20 -29.54 -42.84 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 0.0 110.862 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.561 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 17.9 t80 -48.16 125.84 11.65 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.668 0.747 . . . . 0.0 110.866 -179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 126.99 13.97 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.38 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.7 t -49.88 149.42 2.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 68.3 tttt -80.11 -67.9 0.72 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.926 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.504 ' O ' ' N ' ' A' ' 464' ' ' HIS . 48.0 mt -43.78 -60.42 1.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.895 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.422 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 92.4 t80 -39.22 -25.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.913 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.551 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 28.4 m-70 -99.0 -53.23 3.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.861 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 73.4 p -32.61 -43.27 0.09 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.142 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 82.7 p -127.37 -35.92 2.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.153 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.422 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.02 -40.42 1.45 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -105.04 172.65 6.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 0.0 110.888 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.3 t -129.56 119.18 23.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.905 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -51.94 -30.27 12.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.078 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -50.45 -63.35 1.15 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 143.57 -162.44 27.67 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.528 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.1 -37.6 75.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.864 0.364 . . . . 0.0 110.894 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -99.88 65.14 1.29 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.887 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 20.9 t -78.18 151.88 32.99 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.858 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.8 ppp? -69.86 -19.41 63.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.865 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 20.5 m-85 -101.46 155.99 17.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.865 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 35.1 m -78.66 142.92 36.78 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.853 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -115.18 35.15 4.48 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.9 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -73.22 161.17 80.52 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.596 0.712 . . . . 0.0 110.897 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.74 116.5 4.59 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.645 2.23 . . . . 0.0 112.348 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.551 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.0 mt -40.53 146.31 0.15 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.914 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 77.3 p -125.26 156.25 38.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.126 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -40.42 -33.57 0.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.928 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 52.2 mm-40 -80.46 -75.21 0.28 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.889 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.614 ' HA ' HD12 ' A' ' 489' ' ' LEU . 20.3 p -41.17 -49.52 3.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.18 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -46.92 2.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.841 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -61.97 -45.98 91.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.893 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.844 HD22 ' O ' ' A' ' 434' ' ' ARG . 80.7 mt -45.4 -62.24 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.946 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 38.8 mt -41.86 -61.31 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.906 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.8 -47.6 2.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 14.4 tptm -68.4 -43.47 77.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.887 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . 0.443 ' CE ' HD22 ' A' ' 494' ' ' LEU . 14.5 tmm? -56.92 -60.34 3.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.91 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.443 HD22 ' CE ' ' A' ' 493' ' ' MET . 4.0 mm? -54.39 -36.95 64.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.927 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -57.07 -41.76 79.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.084 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -50.91 -46.09 60.57 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.832 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -77.07 -56.0 4.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.846 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -45.15 -51.94 9.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.091 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -55.09 -53.16 59.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.885 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -39.12 -47.36 1.55 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.097 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -65.56 -90.21 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.435 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -104.76 175.61 5.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.766 0.317 . . . . 0.0 111.083 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -109.71 147.85 32.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -157.71 165.44 35.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.827 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -118.52 127.62 53.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 10.7 ttmt -108.1 159.75 16.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.88 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -157.05 141.72 16.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.882 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.504 HG13 ' O ' ' A' ' 508' ' ' VAL . 3.6 p -126.62 82.54 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.095 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.87 151.54 46.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . 0.409 ' CD ' ' H ' ' A' ' 510' ' ' GLU . 1.6 pm0 -98.0 166.9 11.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.86 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 4.1 mp -98.71 -67.54 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.935 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 10.9 pttp -129.3 80.28 1.96 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.87 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 3.9 mmmm -96.46 81.11 3.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.865 179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 74.2 p -172.84 169.39 4.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -171.5 96.52 0.11 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.495 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 179.04 3.98 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.72 2.28 . . . . 0.0 112.321 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 26.3 p -156.59 174.94 14.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.874 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 75.2 p -166.17 174.4 9.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.853 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 CA-C-O 119.144 -0.809 . . . . 0.0 112.476 179.999 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 112.469 -0.253 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 15.8 m -141.98 118.0 10.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 36.8 t -174.99 144.38 0.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.876 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -159.91 38.88 0.46 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.519 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 5.7 m -102.84 40.7 1.33 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.851 0.357 . . . . 0.0 110.858 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 71.6 m -80.02 123.61 27.98 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 88.64 156.36 31.08 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.484 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -48.64 143.16 5.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.869 0.366 . . . . 0.0 110.861 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.707 ' N ' HD13 ' A' ' 430' ' ' LEU . 0.0 OUTLIER -128.44 156.59 76.76 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.555 0.693 . . . . 0.0 110.91 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -91.12 0.01 OUTLIER 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.677 2.251 . . . . 0.0 112.35 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 28.1 mmtp -45.29 120.2 2.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.933 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.46 ' HG3' ' CZ ' ' A' ' 453' ' ' TYR . 26.2 mmmt -83.49 -32.59 25.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.911 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.755 ' O ' HD22 ' A' ' 489' ' ' LEU . 16.7 tpp180 60.64 35.74 19.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.875 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 70.7 mt-10 -128.02 176.31 7.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.874 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 33.8 tp -75.39 121.87 22.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.962 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . 0.45 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.2 t -59.82 131.38 50.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.889 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 2.05 7.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.926 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -119.0 -40.56 2.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.455 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 34.5 t80 -54.46 -28.37 43.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.8 mt -45.57 -32.4 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 18.5 p -102.31 -29.7 11.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.115 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.19 -10.33 17.57 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.497 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 13.2 t80 -99.98 97.95 8.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.848 0.356 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 11.6 t -131.63 108.01 9.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.896 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.65 -66.19 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.096 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 19.2 mtm-85 -71.19 104.89 3.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.861 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -77.36 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.074 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -81.7 -2.79 51.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.879 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -114.11 24.6 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.872 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.3 t -80.18 114.54 47.72 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.873 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 2.68 3.34 Favored 'Trans proline' 0 C--O 1.231 0.13 0 C-N-CA 122.675 2.25 . . . . 0.0 112.369 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.46 ' CZ ' ' HG3' ' A' ' 433' ' ' LYS . 75.6 m-85 -115.53 -174.37 2.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 31.8 mmm -100.03 150.19 22.7 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.877 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.455 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 30.3 m170 -125.65 -77.21 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.872 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -81.13 -60.09 2.32 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.465 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -39.32 -43.46 1.16 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.351 . . . . 0.0 110.865 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 20.3 t80 -46.61 127.7 8.21 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.662 0.744 . . . . 0.0 110.903 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 140.27 42.14 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 0.0 112.339 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 6.2 t -61.7 146.34 49.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.875 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.584 ' NZ ' HD23 ' A' ' 494' ' ' LEU . 34.4 tttp -80.14 -68.72 0.65 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.902 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.44 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.7 mt -44.89 -56.85 4.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.94 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.443 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 44.7 t80 -40.0 -27.31 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.9 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.554 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 32.5 m-70 -98.63 -52.69 3.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.873 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.512 HG23 ' O ' ' A' ' 461' ' ' LYS . 31.9 p -34.21 -35.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.139 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 464' ' ' HIS . 76.8 p -132.74 -39.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.124 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.443 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.82 -38.99 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.501 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -109.14 152.16 25.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.859 0.362 . . . . 0.0 110.895 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 37.9 t -105.35 141.44 36.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.884 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.1 tp -72.91 -31.94 37.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.15 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -50.83 -68.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 144.45 -157.19 27.12 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.493 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.51 -29.06 61.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.779 0.323 . . . . 0.0 110.864 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -104.51 53.91 0.73 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 44.2 t -73.61 148.47 42.86 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.487 ' SD ' ' CZ ' ' A' ' 477' ' ' PHE . 4.4 ppp? -79.3 11.05 3.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.881 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.487 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 12.6 m-85 -124.59 158.1 33.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.92 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 2.8 m -76.8 134.02 39.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 23.3 m170 -109.33 20.27 18.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.826 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . 0.413 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 0.0 OUTLIER -67.79 158.92 81.63 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.601 0.715 . . . . 0.0 110.86 -179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.1 Cg_endo -69.73 117.85 5.33 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.672 2.248 . . . . 0.0 112.374 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.554 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 88.8 mt -39.29 140.1 0.46 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.923 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 12.1 p -120.44 154.56 35.02 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -41.1 -29.12 0.11 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -79.97 -75.56 0.25 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.89 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.479 ' O ' ' N ' ' A' ' 489' ' ' LEU . 15.2 p -46.25 -47.88 18.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.121 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -39.68 -39.3 0.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -65.25 -38.91 91.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.755 HD22 ' O ' ' A' ' 434' ' ' ARG . 84.2 mt -50.44 -61.66 2.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.915 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 57.1 mt -41.43 -55.72 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.946 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -39.71 -45.37 1.69 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.861 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.17 -36.87 39.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.8 tmm? -65.27 -66.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.584 HD23 ' NZ ' ' A' ' 461' ' ' LYS . 16.2 mt -40.07 -49.02 2.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.904 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.31 -43.65 97.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.128 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.36 -48.26 79.49 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.845 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -64.92 -69.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -43.4 -49.1 7.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.087 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -63.59 -58.36 7.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -85.0 96.58 9.44 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.09 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -100.51 40.83 2.3 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.502 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -150.96 123.7 8.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.77 0.319 . . . . 0.0 111.087 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.25 107.32 5.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.875 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -44.58 164.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.886 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -120.06 176.03 5.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.903 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -118.9 161.0 20.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.896 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . 0.469 ' HG2' ' N ' ' A' ' 508' ' ' VAL . 23.0 tt0 -127.57 149.97 49.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.873 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.469 ' N ' ' HG2' ' A' ' 507' ' ' GLU . 2.7 p -92.34 121.62 43.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.161 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -92.56 140.62 29.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.824 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -46.0 154.44 0.24 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.42 ' O ' ' C ' ' A' ' 512' ' ' LYS . 54.0 mt -90.48 47.96 1.49 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.872 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.42 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER 35.66 39.84 0.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.02 122.97 4.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.885 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 89.1 p -165.45 171.39 13.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.871 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 145.32 89.69 0.1 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.512 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -176.54 1.51 Allowed 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.65 2.233 . . . . 0.0 112.361 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 49.1 m -107.22 168.34 9.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.867 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 35.6 t -135.06 162.26 32.96 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.856 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.271 0 CA-C-O 119.152 -0.804 . . . . 0.0 112.49 179.99 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 43.4 t -49.41 -43.22 44.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.869 0.366 . . . . 0.0 110.847 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 67.0 m -77.27 154.68 32.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.873 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 121.46 82.96 0.69 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.493 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 8.0 m -133.47 141.82 47.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.902 0.382 . . . . 0.0 110.867 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 25.5 p -95.12 135.97 36.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 168.21 70.48 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.473 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 20.3 mp0 -85.66 116.07 23.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.88 0.372 . . . . 0.0 110.939 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -80.71 155.82 73.19 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.583 0.706 . . . . 0.0 110.939 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 3.7 2.64 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.673 2.249 . . . . 0.0 112.319 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -86.0 -176.68 6.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.934 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -144.09 135.97 26.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.918 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.401 ' C ' ' CD ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -91.28 33.65 0.97 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.898 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -107.99 143.94 35.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.913 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.578 HD13 ' CD2' ' A' ' 458' ' ' PHE . 31.7 tp -66.98 120.66 14.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.882 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 33.3 t -59.12 134.02 56.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.878 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -79.37 12.08 2.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.88 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -117.71 -41.94 2.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.883 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 23.4 t80 -59.14 -33.41 70.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 70.6 mt -42.83 -33.0 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.15 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 35.4 p -101.48 -37.13 8.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.138 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.5 -8.42 17.58 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -100.13 80.97 2.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.897 0.38 . . . . 0.0 110.865 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 47.1 t -118.56 104.62 10.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.96 -64.07 0.53 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 79.3 mtt180 -78.21 105.56 9.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.852 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.42 -77.9 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.91 14.3 2.82 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.838 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -113.29 -17.25 12.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.856 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 8.0 t -65.95 111.21 5.9 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.552 0.692 . . . . 0.0 110.895 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 3.64 2.62 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.704 2.269 . . . . 0.0 112.349 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -100.17 170.69 8.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.939 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 17.6 mmm -81.94 141.28 33.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.875 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -120.91 -77.61 0.59 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.843 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.8 -60.17 2.35 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.47 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.45 ' C ' ' O ' ' A' ' 456' ' ' GLY . 14.7 m-20 -34.45 -46.66 0.28 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.775 0.321 . . . . 0.0 110.832 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.578 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.6 t80 -46.65 126.21 8.09 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.664 0.745 . . . . 0.0 110.855 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 134.42 27.94 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.688 2.258 . . . . 0.0 112.331 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.4 t -53.16 145.19 14.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.906 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.484 ' O ' HG23 ' A' ' 465' ' ' THR . 21.0 tttm -80.12 -67.64 0.75 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.912 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 464' ' ' HIS . 29.6 mt -44.76 -58.83 2.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.942 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.449 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 25.1 t80 -39.43 -25.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.96 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.516 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 30.4 m-70 -99.98 -54.15 2.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.851 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 461' ' ' LYS . 33.8 p -33.79 -40.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.142 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 80.6 p -126.92 -33.18 2.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.127 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.449 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 131.81 -40.24 1.66 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.505 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -109.8 149.92 29.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 0.0 110.899 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.9 t -101.62 143.8 31.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.862 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.8 tp -71.34 -39.09 71.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.096 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -49.74 -68.13 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.903 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 141.58 -154.81 24.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.498 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -74.38 -24.49 59.14 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.829 0.347 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -101.69 49.27 0.87 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.842 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -79.26 148.08 32.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.522 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 3.6 ppp? -80.57 17.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.882 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.522 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 12.4 m-85 -129.43 157.38 42.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.5 p -80.07 128.68 33.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.877 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.3 m170 -103.87 21.94 15.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.879 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.46 158.67 86.26 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.614 0.721 . . . . 0.0 110.845 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 119.28 6.26 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.665 2.243 . . . . 0.0 112.387 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.516 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 39.8 mt -42.5 150.2 0.15 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.947 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 78.0 p -128.79 154.9 45.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.145 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -39.92 -30.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.896 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -80.66 -75.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.9 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.447 ' O ' ' N ' ' A' ' 489' ' ' LEU . 20.7 p -46.99 -46.84 21.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.146 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -43.58 1.25 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.841 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -58.29 -40.5 82.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.937 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.447 ' N ' ' O ' ' A' ' 486' ' ' THR . 48.6 mt -49.87 -64.29 0.85 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.437 HD11 HD21 ' A' ' 482' ' ' LEU . 85.2 mt -42.99 -54.0 4.48 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -41.38 -44.9 2.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.839 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -78.07 -59.18 2.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.878 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -44.19 -60.14 2.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.895 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 55.4 mt -41.39 -59.87 1.45 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.91 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -49.37 -52.32 29.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.109 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -42.43 -56.57 2.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.431 ' O ' ' C ' ' A' ' 498' ' ' ALA . 10.7 t0 -73.73 -63.69 1.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.86 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.431 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -33.59 -38.97 0.05 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -78.09 -61.21 2.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.883 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . 40.31 39.83 0.74 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.123 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -52.69 -43.85 59.97 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.46 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -121.57 85.22 2.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.776 0.322 . . . . 0.0 111.099 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -107.55 111.16 23.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.872 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -82.43 87.37 6.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.888 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -47.43 153.44 0.52 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.877 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -158.17 105.0 1.9 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.878 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -94.13 107.58 19.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.927 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.412 HG22 ' H ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -75.21 85.31 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.138 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -50.97 141.3 13.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -48.08 149.86 1.33 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.894 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.765 ' H ' HD13 ' A' ' 511' ' ' LEU . 0.0 OUTLIER -80.74 36.42 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 4.1 mtpm? 46.69 40.84 9.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.92 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 28.9 pttt -40.1 150.04 0.06 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.86 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 33.1 p -144.94 176.87 9.16 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.844 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -175.98 104.73 0.19 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.473 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.79 -176.1 1.38 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.657 2.238 . . . . 0.0 112.361 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 53.8 p -156.34 177.37 11.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.842 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 79.7 p -157.61 173.08 17.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.914 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 CA-C-O 119.14 -0.811 . . . . 0.0 112.485 -179.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.348 0 N-CA-C 112.468 -0.253 . . . . 0.0 112.468 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 80.1 p -121.58 109.95 15.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.844 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 16.7 m -118.07 107.02 13.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.926 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -104.67 128.39 9.44 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.51 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 4.0 t -126.66 160.85 29.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.862 0.363 . . . . 0.0 110.893 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . 0.421 ' HB2' ' NH2' ' A' ' 434' ' ' ARG . 52.8 p -103.3 83.21 2.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.854 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 65.49 115.31 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.497 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -79.34 44.91 0.62 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.869 0.366 . . . . 0.0 110.888 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.531 ' O ' HD23 ' A' ' 430' ' ' LEU . 0.6 OUTLIER -158.08 159.26 30.29 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.582 0.706 . . . . 0.0 110.927 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 97.48 0.64 Allowed 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.663 2.242 . . . . 0.0 112.341 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 22.8 mmtt -150.43 149.25 29.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -124.97 138.15 54.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.901 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.465 ' CG ' ' CD2' ' A' ' 489' ' ' LEU . 0.2 OUTLIER -105.67 47.59 0.87 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.844 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -124.82 143.7 50.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.881 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 458' ' ' PHE . 20.6 tp -73.59 102.65 3.94 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.89 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 9.8 t -40.02 124.1 1.76 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.883 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -68.05 -3.02 8.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.864 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -102.37 -51.52 3.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.85 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -47.78 -37.77 14.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.963 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 76.7 mt -41.17 -31.09 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.123 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 40.6 p -103.05 -33.93 9.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.144 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.94 -10.47 15.46 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.497 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -99.97 97.82 8.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.867 0.365 . . . . 0.0 110.902 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 53.2 t -133.67 110.2 9.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.878 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.092 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.432 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 68.4 mtt180 -77.5 109.54 11.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.841 -179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.62 -77.16 0.21 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.125 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -81.74 5.8 17.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.856 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.7 m-80 -103.29 -20.07 14.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.922 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 10.2 t -60.86 110.26 2.8 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.611 0.719 . . . . 0.0 110.872 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.404 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.4 Cg_endo -69.75 4.27 2.29 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.694 2.263 . . . . 0.0 112.332 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -99.8 178.33 4.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.918 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 22.7 mmm -91.62 140.42 29.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.85 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -120.59 -76.17 0.58 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.49 -64.95 1.77 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.495 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 28.0 t0 -32.6 -48.01 0.18 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.82 0.343 . . . . 0.0 110.871 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 436' ' ' LEU . 19.9 t80 -40.55 125.92 1.84 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.693 0.759 . . . . 0.0 110.886 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 155.74 65.05 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.637 2.225 . . . . 0.0 112.36 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.514 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 14.0 t -73.5 146.03 45.18 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.913 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.405 ' O ' HG23 ' A' ' 465' ' ' THR . 45.5 tttp -79.54 -69.47 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.885 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.489 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.3 mt -44.14 -59.56 2.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.909 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.432 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 58.3 t80 -39.56 -25.5 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.553 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.7 m-70 -98.94 -50.83 4.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.823 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.428 ' C ' ' O ' ' A' ' 464' ' ' HIS . 55.2 p -35.59 -43.24 0.26 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 32.5 p -125.96 -33.75 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.158 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.432 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 135.15 -38.12 1.84 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.753 -0.736 . . . . 0.0 112.514 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -108.56 166.24 10.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.867 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 8.2 t -126.25 131.77 51.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.89 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.407 ' O ' HG13 ' A' ' 470' ' ' ILE . 5.4 tp -80.66 21.55 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 31.4 m-20 -99.57 -46.89 5.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 114.81 174.31 18.24 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.503 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -57.5 -17.38 13.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.853 0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -101.56 43.49 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.888 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 40.4 t -73.83 146.18 44.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.902 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.6 ppp? -71.59 -22.05 61.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.854 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 16.9 m-85 -100.55 159.19 15.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.88 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.6 m -79.94 135.9 36.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -101.02 24.46 9.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.853 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 25.5 p-10 -62.51 153.44 77.16 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.582 0.705 . . . . 0.0 110.876 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 119.94 6.81 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.693 2.262 . . . . 0.0 112.355 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.556 HD21 HD11 ' A' ' 490' ' ' LEU . 80.0 mt -41.18 143.73 0.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.92 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 10.7 p -138.65 162.0 35.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.105 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -39.46 -35.63 0.3 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.881 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -80.22 -68.99 0.62 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.853 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.427 ' O ' ' N ' ' A' ' 489' ' ' LEU . 5.7 p -52.89 -55.13 25.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.154 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.29 -49.2 1.92 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.872 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -52.24 -39.18 59.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.465 ' CD2' ' CG ' ' A' ' 434' ' ' ARG . 65.1 mt -49.6 -65.89 0.49 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.922 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.556 HD11 HD21 ' A' ' 482' ' ' LEU . 72.7 mt -39.81 -61.12 0.88 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.917 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.91 -39.56 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.842 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -79.47 -40.89 28.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.2 tmm? -62.21 -59.76 4.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.872 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.88 -45.56 30.51 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -64.56 -39.63 94.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.087 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -54.41 -40.62 68.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.833 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -70.69 -62.72 1.28 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.791 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -50.53 -61.17 2.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.081 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.436 ' C ' ' O ' ' A' ' 498' ' ' ALA . 15.8 tp10 -34.56 -51.04 0.46 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.888 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.5 96.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.136 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -173.35 -68.8 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.501 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -122.12 134.64 54.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.801 0.334 . . . . 0.0 111.126 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -69.97 81.18 0.48 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.92 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -110.22 114.5 28.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.871 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -113.74 103.4 11.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.844 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 15.0 pttm -116.69 167.77 10.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.941 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -149.27 145.04 26.87 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.536 HG13 ' O ' ' A' ' 508' ' ' VAL . 10.8 p -80.53 115.99 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.17 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -62.51 167.92 4.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.89 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 130.26 40.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.873 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 77.6 mt -115.95 -41.71 3.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.925 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? -89.81 38.83 0.93 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.889 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -87.0 107.07 18.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.925 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 3.9 t -132.58 172.54 12.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.826 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -140.79 167.43 25.61 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.514 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 128.43 15.99 Favored 'Trans proline' 0 C--O 1.231 0.125 0 C-N-CA 122.705 2.27 . . . . 0.0 112.337 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 71.3 m -82.75 159.1 22.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.849 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 15.2 m -110.5 149.12 30.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.513 -179.999 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.333 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 20.5 m -152.42 145.96 24.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.903 0.382 . . . . 0.0 110.807 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 80.4 p -141.3 144.15 34.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.842 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 114.86 59.55 0.37 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 88.7 p -84.89 -47.18 10.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.881 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 9.1 t -112.67 131.82 55.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.84 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -139.31 50.37 0.79 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.511 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -125.55 90.32 3.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.918 0.39 . . . . 0.0 110.861 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.5 mp -81.07 158.56 69.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.634 0.731 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.11 3.82 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.686 2.257 . . . . 0.0 112.347 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -144.61 178.85 7.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.47 ' N ' ' O ' ' A' ' 452' ' ' PRO . 41.2 mttt -137.13 144.05 42.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.412 ' HD3' ' O ' ' A' ' 434' ' ' ARG . 0.0 OUTLIER -97.76 33.78 2.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.893 -179.994 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -115.84 149.18 39.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.894 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.515 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.7 tp -79.39 105.45 10.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.874 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 23.5 t -41.79 131.48 3.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.89 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 14.5 mmmt -80.95 21.79 0.67 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.901 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -125.33 -42.2 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.905 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -64.01 -27.7 69.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.924 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 96.5 mt -44.72 -37.19 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.3 -27.76 13.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.177 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 116.62 -10.17 16.45 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -100.73 105.76 17.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.891 0.377 . . . . 0.0 110.884 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 40.4 t -138.45 122.26 17.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.869 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -46.18 -67.45 0.28 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.155 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -86.12 114.47 23.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.86 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.64 -79.17 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.155 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 25.8 pt-20 -81.74 12.79 3.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.911 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -116.55 1.73 12.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.883 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 12.9 t -80.18 110.99 18.54 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.621 0.724 . . . . 0.0 110.866 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.47 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.3 Cg_endo -69.77 7.08 1.08 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -99.25 -177.15 3.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 44.3 mmm -97.84 126.25 43.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.873 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.9 m170 -109.95 -74.89 0.64 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.869 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.51 -60.28 2.37 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.458 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 51.6 m-20 -34.48 -45.46 0.23 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.858 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.515 ' CD2' HD13 ' A' ' 436' ' ' LEU . 27.8 t80 -47.03 128.77 9.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.654 0.74 . . . . 0.0 110.879 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 150.79 68.92 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.713 2.275 . . . . 0.0 112.323 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.405 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.6 t -75.72 150.07 37.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.451 ' O ' HG23 ' A' ' 465' ' ' THR . 9.3 ttmt -80.01 -68.5 0.67 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.915 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.471 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.5 mt -45.5 -57.54 4.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 64.5 t80 -40.71 -24.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.565 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 25.9 m-70 -99.9 -53.39 3.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.872 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 461' ' ' LYS . 43.6 p -34.7 -43.48 0.18 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.105 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 72.2 p -124.68 -35.23 2.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.13 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 136.46 -38.57 1.75 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.531 180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -107.09 169.83 8.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.88 0.371 . . . . 0.0 110.866 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 16.8 t -124.56 133.76 53.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.909 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.39 -38.84 82.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.128 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -50.28 -54.83 18.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.916 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 124.16 -159.35 18.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.449 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.77 -25.11 61.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.775 0.321 . . . . 0.0 110.826 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -99.95 47.21 0.95 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 33.9 t -78.1 149.41 33.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.883 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.6 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -80.66 18.54 0.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.6 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 20.2 m-85 -131.39 156.05 46.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.914 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.4 m -79.0 128.33 33.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.86 -179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.3 m170 -103.02 25.13 9.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.831 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.23 160.3 79.44 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.593 0.711 . . . . 0.0 110.867 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 116.84 4.75 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.647 2.232 . . . . 0.0 112.359 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.565 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 37.8 mt -40.18 144.85 0.19 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.908 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 72.3 p -131.91 160.26 36.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.15 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -41.32 -32.67 0.32 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.89 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -78.27 -71.59 0.42 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.885 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.5 p -48.91 -51.15 31.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.126 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.427 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.47 -52.61 2.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.855 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -51.04 -49.7 60.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.901 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 94.2 mt -43.9 -65.18 0.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.899 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 35.9 mt -40.01 -57.32 1.66 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.7 -40.4 5.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.887 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.81 -52.43 9.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.3 tmm? -53.83 -64.47 0.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.887 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 18.3 mt -47.87 -56.39 7.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.933 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.17 -55.61 9.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.093 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.04 -48.57 75.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.862 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -38.76 -60.59 0.82 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.903 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.434 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -79.07 -56.26 4.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.059 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.434 ' C ' ' O ' ' A' ' 498' ' ' ALA . 12.5 tp10 -35.43 -45.6 0.34 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.88 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.428 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -34.51 98.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.077 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -125.28 -65.25 0.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.762 . . . . 0.0 112.494 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -87.77 177.8 6.91 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.725 0.298 . . . . 0.0 111.112 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -147.86 160.23 43.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.915 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -166.32 119.5 1.07 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.867 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -84.52 169.44 14.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.864 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 17.7 mtmm -83.26 170.21 14.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.916 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -130.96 170.3 14.65 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.907 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 508' ' ' VAL . 7.9 p -120.6 110.3 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.133 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -67.84 160.66 27.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.925 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.07 148.29 44.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 16.6 mt -52.55 -173.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.96 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.4 ' O ' ' C ' ' A' ' 513' ' ' LYS . 0.1 OUTLIER -74.65 50.76 0.44 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.915 179.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . 0.4 ' C ' ' O ' ' A' ' 512' ' ' LYS . 38.8 tttm -38.01 124.88 1.2 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.904 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 1.4 t -168.41 168.31 11.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.886 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -174.1 134.34 2.81 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.483 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -175.03 1.02 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.719 2.28 . . . . 0.0 112.355 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 67.6 m -153.8 140.48 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.865 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 14.9 m -117.77 171.4 8.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.861 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 CA-C-O 119.146 -0.808 . . . . 0.0 112.489 179.984 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 17.3 t -111.22 139.67 46.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.854 0.359 . . . . 0.0 110.817 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 60.5 p -99.87 160.48 14.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.841 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -105.26 -101.2 2.69 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.485 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 3.8 m -114.44 138.69 50.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.87 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 20.6 t -89.78 -44.6 9.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.872 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 166.75 149.84 6.15 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.506 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mp0 -112.14 151.28 29.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.887 0.375 . . . . 0.0 110.884 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 5.4 mp -109.63 154.35 42.46 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.605 0.717 . . . . 0.0 110.9 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -0.29 6.69 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.694 2.263 . . . . 0.0 112.304 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 37.8 mttp -82.95 171.6 13.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.924 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -120.59 136.54 54.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.91 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.543 ' HB3' HD23 ' A' ' 489' ' ' LEU . 8.2 mpt_? -92.63 41.67 1.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.851 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -122.12 152.68 39.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.893 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.52 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 13.4 tp -78.93 115.75 18.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 27.0 t -45.68 131.11 9.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -75.24 0.55 16.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.927 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -108.17 -50.11 3.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.86 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.434 ' CE2' ' HE1' ' A' ' 476' ' ' MET . 11.7 t80 -49.05 -30.05 5.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.909 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 79.8 mt -44.46 -33.75 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.086 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 60.2 p -103.91 -29.23 11.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.107 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 114.11 -10.11 22.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.502 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -98.6 99.38 10.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.1 t -135.86 104.81 5.87 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.853 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.44 -61.78 0.87 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.134 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 73.0 mtt180 -81.92 104.64 12.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.915 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.08 -74.87 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.087 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -81.42 2.7 27.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.899 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -104.51 -5.26 21.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.929 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 6.3 t -72.56 111.59 11.7 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.624 0.726 . . . . 0.0 110.864 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 2.02 3.88 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.688 2.259 . . . . 0.0 112.388 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -100.32 -174.64 2.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.922 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 29.1 mmm -98.19 142.34 29.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.877 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -121.23 -75.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.469 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.69 -66.28 1.65 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.43 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.469 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -33.0 -42.57 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.863 0.363 . . . . 0.0 110.871 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.52 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.8 t80 -46.79 126.93 8.45 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.684 0.754 . . . . 0.0 110.861 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 144.94 55.45 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.255 . . . . 0.0 112.333 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 51.9 t -69.26 143.24 53.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.882 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.429 ' O ' HG23 ' A' ' 465' ' ' THR . 4.7 ttpm? -79.38 -65.29 1.02 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.89 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 464' ' ' HIS . 31.5 mt -45.0 -57.84 3.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.912 179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -40.51 -24.56 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.922 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.574 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 45.1 m-70 -100.66 -52.49 3.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.86 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.458 ' C ' ' O ' ' A' ' 464' ' ' HIS . 58.3 p -32.24 -42.28 0.06 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.158 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 62.8 p -127.84 -36.92 1.97 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 134.15 -33.18 2.56 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.475 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -116.81 143.73 45.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.839 0.352 . . . . 0.0 110.914 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.4 t -101.92 107.33 18.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.6 tp -40.49 -36.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.185 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 58.1 m-20 -53.2 -61.87 2.02 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.881 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 107.45 -142.07 15.74 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -80.18 13.43 2.33 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.777 0.322 . . . . 0.0 110.841 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -106.72 -25.22 11.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.895 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -43.14 125.87 3.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.605 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 0.8 OUTLIER -81.56 27.2 0.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.898 179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 32.1 m-85 -125.29 158.1 34.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.87 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.6 m -80.12 137.68 36.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.831 -179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 38.0 m170 -108.59 17.98 21.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.888 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -60.31 153.43 58.78 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.58 0.705 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 117.13 4.9 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.709 2.273 . . . . 0.0 112.351 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 490' ' ' LEU . 23.7 mt -39.65 151.73 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 40.5 p -139.18 165.58 26.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.113 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . 0.43 ' HG3' ' CD ' ' A' ' 485' ' ' GLU . 9.9 pt-20 -40.27 -38.5 0.8 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.861 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.43 ' CD ' ' HG3' ' A' ' 484' ' ' GLU . 48.0 mp0 -80.43 -76.3 0.23 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.915 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.446 ' O ' ' N ' ' A' ' 489' ' ' LEU . 17.4 p -41.49 -50.92 3.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.124 -179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.474 ' HD3' HD13 ' A' ' 482' ' ' LEU . 12.0 tpt180 -39.41 -44.36 1.34 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.829 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -58.15 -40.08 80.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.543 HD23 ' HB3' ' A' ' 434' ' ' ARG . 88.3 mt -46.68 -68.14 0.22 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 482' ' ' LEU . 92.8 mt -40.43 -57.55 1.77 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.896 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -42.54 -36.11 1.26 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.857 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 8.5 ttmt -80.17 -38.47 31.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.899 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.3 tmm? -68.88 -62.64 1.29 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.829 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -39.9 -49.18 2.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.896 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.79 84.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.093 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -47.81 -41.3 23.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.861 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 500' ' ' ALA . 8.5 t70 -68.72 -66.37 0.58 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.861 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -48.78 -61.87 1.81 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.144 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.402 ' O ' ' C ' ' A' ' 500' ' ' ALA . 27.0 mt-10 -59.04 -50.19 75.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.922 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 497' ' ' ASP . . . 37.2 42.1 0.26 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.116 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 179.58 48.71 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.493 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -122.2 78.84 1.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.714 0.292 . . . . 0.0 111.08 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -123.44 82.25 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.876 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -100.03 94.49 6.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.83 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -48.9 119.06 2.93 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.886 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.23 115.18 17.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.959 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -53.74 108.87 0.39 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.83 92.8 2.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.106 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 172.46 6.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -114.31 151.46 32.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.855 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.473 ' H ' HD12 ' A' ' 511' ' ' LEU . 5.6 mp -53.95 -173.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.931 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -74.75 49.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.939 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -45.84 131.72 9.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.91 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 58.8 m -167.0 162.64 15.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.832 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -116.83 115.81 3.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.497 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.1 69.16 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.65 2.233 . . . . 0.0 112.359 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.4 t -122.67 158.95 28.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 23.5 m -111.45 173.27 6.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.856 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 CA-C-O 119.183 -0.787 . . . . 0.0 112.449 179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 93.8 p -95.13 135.97 36.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.863 0.363 . . . . 0.0 110.894 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 3.3 t -86.21 137.93 32.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.867 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -101.56 86.02 0.58 Allowed Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.439 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 95.3 p -82.49 43.22 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.879 0.371 . . . . 0.0 110.847 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 57.7 m -107.06 149.15 27.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 158.89 57.06 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.514 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -84.56 101.02 11.78 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.883 0.373 . . . . 0.0 110.828 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -101.15 150.75 37.38 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.591 0.71 . . . . 0.0 110.9 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 -91.55 0.01 OUTLIER 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.664 2.243 . . . . 0.0 112.386 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 20.9 mmtp -80.28 175.92 10.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.896 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -94.9 -23.0 17.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.902 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 57.48 42.08 25.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -138.32 154.29 48.99 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.624 HD13 ' CD2' ' A' ' 458' ' ' PHE . 32.8 tp -79.54 105.09 10.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.939 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.7 t -40.52 123.78 1.88 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.889 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm -69.41 -3.16 13.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -105.28 -51.43 3.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.887 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.423 ' HB2' ' NE2' ' A' ' 455' ' ' HIS . 31.6 t80 -44.58 -37.64 3.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.93 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 78.6 mt -41.03 -36.24 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.147 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 11.1 p -101.21 -35.23 9.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.101 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.99 -9.81 11.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.489 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . 0.462 ' O ' ' CG ' ' A' ' 444' ' ' PHE . 5.5 t80 -95.31 83.25 3.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.904 0.383 . . . . 0.0 110.85 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 22.1 t -118.42 113.93 22.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.875 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -43.95 -72.57 0.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.114 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 84.2 mtt85 -80.17 109.41 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.9 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.65 -73.82 0.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.098 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 47.0 tt0 -76.06 -5.66 47.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.905 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -110.47 20.34 17.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.903 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 37.6 t -80.53 111.81 25.99 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.629 0.728 . . . . 0.0 110.909 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 1.43 4.46 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.691 2.261 . . . . 0.0 112.359 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -105.67 -176.08 2.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.921 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . 0.484 ' CE ' ' HB2' ' A' ' 457' ' ' ASP . 29.1 mmm -100.78 140.58 34.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.924 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.423 ' NE2' ' HB2' ' A' ' 440' ' ' TYR . 20.4 m170 -119.9 -75.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.86 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.466 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -78.13 -67.3 1.64 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.484 ' HB2' ' CE ' ' A' ' 454' ' ' MET . 7.5 m-20 -32.99 -44.72 0.12 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.856 0.36 . . . . 0.0 110.884 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.624 ' CD2' HD13 ' A' ' 436' ' ' LEU . 15.2 t80 -45.28 126.24 5.82 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.633 0.73 . . . . 0.0 110.897 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 143.58 51.48 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.699 2.266 . . . . 0.0 112.341 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.432 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.1 t -70.69 145.03 50.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.869 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 19.9 ttpp -77.25 -64.99 1.01 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.899 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.8 mt -44.73 -59.44 2.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.446 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 87.5 t80 -39.62 -25.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.94 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 462' ' ' LEU . 42.9 m-70 -98.87 -53.61 3.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.885 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 464' ' ' HIS . 51.2 p -34.48 -34.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.126 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.0 p -133.59 -40.65 0.87 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.124 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.446 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 141.22 -38.57 1.52 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.46 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -113.43 152.1 30.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.1 t -102.26 141.73 34.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.446 HG22 HD13 ' A' ' 462' ' ' LEU . 8.3 tp -80.23 -26.08 11.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.12 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -50.92 -49.61 59.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.923 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 129.64 -167.17 21.59 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.478 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.49 -35.79 79.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.831 0.348 . . . . 0.0 110.87 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -100.57 58.8 0.95 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.876 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -74.66 149.08 40.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.934 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.589 ' SD ' ' CE2' ' A' ' 477' ' ' PHE . 5.4 ppp? -76.51 6.57 5.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.881 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.589 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 15.7 m-85 -125.78 154.74 42.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.844 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 23.3 m -80.37 141.44 35.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.887 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.25 26.98 10.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.876 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -64.97 153.76 88.02 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.624 0.726 . . . . 0.0 110.869 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 109.66 2.35 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.698 2.266 . . . . 0.0 112.39 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.447 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 47.4 mt -39.73 152.41 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.875 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' N ' ' A' ' 485' ' ' GLU . 72.5 p -137.46 158.51 44.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.102 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -38.95 -30.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.858 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.414 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.2 mm-40 -81.4 -74.69 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.42 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.1 p -46.24 -47.61 17.98 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.14 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.11 -47.04 1.51 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.86 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -56.99 -41.38 78.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.874 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 486' ' ' THR . 74.1 mt -47.66 -63.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.916 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.454 ' O ' HD23 ' A' ' 494' ' ' LEU . 72.1 mt -39.87 -60.03 1.08 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.929 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -40.26 -45.94 2.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.883 179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 44.3 tttp -72.42 -49.11 35.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.885 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -48.23 -59.22 3.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 490' ' ' LEU . 4.0 mm? -45.79 -47.07 15.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.44 ' O ' ' C ' ' A' ' 496' ' ' ASP . . . -66.91 -65.62 0.66 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.095 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . 0.44 ' C ' ' O ' ' A' ' 495' ' ' ALA . 1.9 m-20 -34.47 -48.59 0.36 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.901 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -40.28 -62.15 0.79 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.412 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -74.3 -55.51 5.95 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.099 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.412 ' C ' ' O ' ' A' ' 498' ' ' ALA . 1.7 tm-20 -36.79 -42.41 0.38 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.917 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -42.25 98.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -110.61 -47.18 0.8 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.471 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -109.52 140.63 43.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.762 0.315 . . . . 0.0 111.09 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -134.63 -34.06 0.94 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.916 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -78.02 110.53 13.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.896 179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -109.84 138.33 46.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 5.7 mmmm -134.92 107.15 7.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.903 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 21.4 tp10 -164.48 133.71 3.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.913 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 4.1 p -112.64 120.35 62.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.115 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -100.71 134.86 43.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -99.72 152.03 20.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.704 HD12 ' O ' ' A' ' 511' ' ' LEU . 3.9 pp -110.53 41.96 1.67 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.878 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 9.5 tptm 65.82 41.59 3.79 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.918 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -54.05 164.57 0.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.953 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 18.5 m 66.32 45.09 2.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.831 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -60.15 156.92 28.61 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.473 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 136.24 32.37 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.252 . . . . 0.0 112.352 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 57.8 m -114.72 109.87 18.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 15.8 t -74.02 -59.57 2.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.834 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 CA-C-O 119.176 -0.791 . . . . 0.0 112.471 -179.98 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.458 -0.257 . . . . 0.0 112.458 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 4.1 t -146.51 133.52 20.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.844 0.354 . . . . 0.0 110.898 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 48.7 m -134.08 115.31 14.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.872 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -162.39 137.34 4.79 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.546 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 40.5 p -161.9 167.52 24.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.913 0.387 . . . . 0.0 110.859 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 13.3 t -164.58 154.14 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.829 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 178.95 75.42 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.47 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.57 162.68 26.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.902 0.382 . . . . 0.0 110.896 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 18.9 mt -149.09 140.52 14.33 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.569 0.7 . . . . 0.0 110.908 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 81.7 0.8 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 0.0 112.344 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -152.3 176.63 11.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.859 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.467 ' HD3' ' CE2' ' A' ' 453' ' ' TYR . 6.9 mtpt -113.44 -18.75 11.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.921 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.472 ' CG ' HD21 ' A' ' 489' ' ' LEU . 0.1 OUTLIER 58.83 38.35 24.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.85 179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.04 135.14 32.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.909 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.739 HD13 ' CD2' ' A' ' 458' ' ' PHE . 53.9 tp -60.61 117.42 5.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.88 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 28.3 t -58.86 126.4 27.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.841 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.32 29.03 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.881 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -134.61 -42.09 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.877 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.605 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 47.1 t80 -66.91 -21.86 65.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.905 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 61.7 mt -52.84 -32.8 18.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.143 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 61.1 p -108.26 11.29 27.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.144 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 76.57 -8.73 25.67 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.513 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -99.67 99.62 10.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 44.3 t -136.26 117.25 14.28 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.918 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -45.09 -67.59 0.27 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.081 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -85.72 114.41 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.891 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.21 -76.0 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.128 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -81.41 -2.57 49.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.875 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -105.59 11.99 31.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.881 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . . . . . . . . . 20.1 t -80.81 111.32 22.38 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.631 0.729 . . . . 0.0 110.876 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 0.77 5.2 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.675 2.25 . . . . 0.0 112.331 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.467 ' CE2' ' HD3' ' A' ' 433' ' ' LYS . 57.6 m-85 -100.3 -174.97 2.8 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.978 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.4 mmm -100.54 143.03 31.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.922 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 440' ' ' TYR . 13.6 m170 -122.04 -75.28 0.6 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.491 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.64 -69.44 1.4 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.466 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.491 ' C ' ' O ' ' A' ' 456' ' ' GLY . 20.3 t0 -31.05 -41.23 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.836 0.35 . . . . 0.0 110.864 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.739 ' CD2' HD13 ' A' ' 436' ' ' LEU . 14.7 t80 -49.31 117.78 7.16 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.686 0.755 . . . . 0.0 110.864 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 129.45 17.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.721 2.281 . . . . 0.0 112.311 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 34.6 t -49.28 138.17 13.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.852 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -73.99 -66.92 0.66 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.921 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 49.0 mt -45.02 -58.7 3.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' A' ' 467' ' ' GLY . 69.4 t80 -39.74 -24.54 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.924 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.58 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 44.4 m-70 -100.75 -53.19 3.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.826 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.498 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.4 p -29.64 -42.08 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.193 -179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.455 ' N ' ' O ' ' A' ' 464' ' ' HIS . 65.9 p -126.66 -39.53 1.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.147 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 463' ' ' TYR . . . 146.72 -38.06 1.16 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.51 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . 0.411 ' C ' ' HA ' ' A' ' 463' ' ' TYR . 45.1 p-10 -113.83 168.93 9.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.855 0.359 . . . . 0.0 110.918 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.33 140.38 48.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.851 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.448 HG22 HD13 ' A' ' 462' ' ' LEU . 7.9 tp -76.98 -33.28 20.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.102 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -50.42 -65.46 0.56 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 145.87 -164.35 28.2 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.502 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.15 -22.63 59.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.822 0.344 . . . . 0.0 110.888 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 13.5 p-10 -99.76 48.89 0.93 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.871 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 54.1 t -79.46 141.32 36.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.915 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.605 ' CE ' ' CE2' ' A' ' 440' ' ' TYR . 4.7 ppp? -81.11 25.93 0.46 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.866 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.605 ' CZ ' ' SD ' ' A' ' 476' ' ' MET . 24.1 m-85 -134.59 157.23 47.1 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.86 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.5 p -80.1 135.47 36.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 30.8 m170 -111.49 28.15 9.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.881 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -74.47 163.32 69.1 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.608 0.718 . . . . 0.0 110.873 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 120.08 6.92 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.701 2.268 . . . . 0.0 112.318 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.58 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 30.3 mt -40.91 143.79 0.34 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.889 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 39.4 p -126.54 156.09 41.36 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.124 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -39.87 -34.1 0.25 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.858 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -76.74 -74.99 0.21 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.879 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 20.4 p -45.16 -50.44 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.146 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.465 ' HD2' ' C ' ' A' ' 487' ' ' ARG . 1.0 OUTLIER -39.03 -49.59 1.75 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -50.83 -45.31 59.57 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.472 HD21 ' CG ' ' A' ' 434' ' ' ARG . 93.8 mt -48.2 -64.1 0.89 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.523 HD11 HD21 ' A' ' 482' ' ' LEU . 97.1 mt -39.82 -53.75 2.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.875 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -46.13 -47.33 17.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.843 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -73.66 -57.74 3.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.86 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 12.1 tmm? -46.4 -64.23 0.81 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.869 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 490' ' ' LEU . 10.5 mp -50.26 -53.94 24.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.953 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -49.44 -47.04 48.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.157 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -49.22 -50.12 39.94 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.835 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -59.88 -57.05 14.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.877 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' A' ' 499' ' ' GLU . . . -58.77 -66.13 0.55 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.113 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 498' ' ' ALA . 36.8 tt0 -31.36 -58.55 0.25 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.882 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -32.3 101.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.136 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 71.84 55.02 7.63 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.45 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -162.16 154.31 19.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 0.0 111.085 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 45.7 tt0 -89.08 141.23 28.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.952 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -140.11 156.86 46.38 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.881 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -147.36 133.85 19.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 8.0 tmtt? -156.65 131.81 9.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.78 164.69 28.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.907 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 86.7 t -109.08 117.72 55.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.084 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -67.93 156.68 36.7 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.872 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -120.61 176.37 5.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.863 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.529 ' H ' HD23 ' A' ' 511' ' ' LEU . 1.7 pt? -124.69 43.64 2.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.452 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER 34.38 53.18 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 179.85 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -45.18 104.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 3.8 t -106.84 -47.67 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.838 -179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 89.65 162.77 38.7 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.505 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 158.17 57.82 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.688 2.259 . . . . 0.0 112.35 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 24.3 p -109.25 141.64 41.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.884 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 78.4 p -111.78 168.51 9.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.857 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 CA-C-O 119.161 -0.799 . . . . 0.0 112.477 -179.979 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 44.1 t -90.24 130.61 36.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.854 0.359 . . . . 0.0 110.85 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 41.9 t -128.33 148.66 50.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.884 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -144.32 153.74 25.28 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.484 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 45.5 t -150.19 163.9 37.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.844 0.354 . . . . 0.0 110.899 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 2.8 m -147.84 161.46 41.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.88 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 132.31 163.0 10.54 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.506 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -70.95 102.69 2.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.874 -179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.797 ' O ' HD22 ' A' ' 430' ' ' LEU . 0.0 OUTLIER -67.35 143.66 97.49 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.65 0.738 . . . . 0.0 110.914 -179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 -92.15 0.01 OUTLIER 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.685 2.257 . . . . 0.0 112.323 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . 0.584 ' O ' HD23 ' A' ' 430' ' ' LEU . 48.1 mmtt -63.33 130.23 43.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.898 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.551 ' HE3' ' CE1' ' A' ' 453' ' ' TYR . 22.6 mtmt -92.21 14.43 16.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.907 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 28.2 mmt180 38.14 50.33 1.37 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . 0.475 ' HB3' ' CD2' ' A' ' 453' ' ' TYR . 14.2 tt0 -138.07 145.05 41.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.918 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.411 HD13 ' CD2' ' A' ' 458' ' ' PHE . 19.6 tp -72.99 112.26 8.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.938 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 18.5 t -43.28 141.75 1.21 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.873 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.476 ' HG2' ' CD1' ' A' ' 439' ' ' PHE . 0.0 OUTLIER -79.89 -5.64 55.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.91 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . 0.476 ' CD1' ' HG2' ' A' ' 438' ' ' LYS . 46.3 m-85 -110.17 -54.03 2.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -42.2 -23.64 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.9 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 439' ' ' PHE . 61.8 mt -50.53 -40.25 18.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.107 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 41.3 p -99.71 6.24 45.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.158 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 79.87 -9.61 44.18 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.464 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -99.85 100.88 11.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.874 0.369 . . . . 0.0 110.881 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 52.3 t -131.41 122.96 27.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -54.5 -59.08 5.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.118 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 97.0 mtt180 -88.65 107.96 19.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.883 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.81 -77.3 0.22 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.124 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -82.59 25.36 0.64 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 -132.87 0.85 3.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.928 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 6.9 t -78.89 111.73 21.96 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.66 0.743 . . . . 0.0 110.869 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 5.17 1.82 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.716 2.277 . . . . 0.0 112.291 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.551 ' CE1' ' HE3' ' A' ' 433' ' ' LYS . 20.7 m-85 -99.93 -176.27 3.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.967 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.2 mmm -95.43 134.61 38.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 11.1 m170 -117.19 -75.51 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.871 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.447 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.29 -62.15 2.12 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.477 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 10.0 m-20 -34.74 -50.69 0.47 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.852 0.358 . . . . 0.0 110.823 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.411 ' CD2' HD13 ' A' ' 436' ' ' LEU . 21.3 t80 -40.14 123.97 1.67 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 0.0 110.865 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 151.5 69.19 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.638 2.225 . . . . 0.0 112.322 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.543 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 6.8 t -73.95 145.96 44.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.404 ' O ' HG23 ' A' ' 465' ' ' THR . 29.6 tttt -78.76 -68.06 0.69 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.905 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' A' ' 464' ' ' HIS . 32.3 mt -44.25 -59.73 2.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.472 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 70.7 t80 -39.5 -25.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.924 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.543 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 30.2 m-70 -99.08 -52.93 3.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.429 ' C ' ' O ' ' A' ' 464' ' ' HIS . 53.1 p -34.75 -35.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.147 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.416 ' N ' ' O ' ' A' ' 464' ' ' HIS . 69.3 p -132.96 -37.3 1.0 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.115 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.472 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 139.34 -41.22 1.35 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.513 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.96 165.71 11.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.896 0.379 . . . . 0.0 110.87 -179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 47.5 t -117.9 150.16 39.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 8.9 tp -79.83 -34.85 15.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.154 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -53.54 -66.16 0.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 135.85 -171.08 22.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.445 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -35.02 62.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.818 0.342 . . . . 0.0 110.854 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -100.22 59.85 1.02 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.867 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 24.7 t -79.47 152.51 30.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.875 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.586 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 3.6 ppp? -68.73 -21.79 64.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.912 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.586 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.6 m-85 -105.51 159.41 15.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.844 -179.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 27.3 m -79.12 140.38 37.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -104.24 24.34 11.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.16 154.6 60.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.6 0.714 . . . . 0.0 110.856 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 120.08 6.93 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.731 2.288 . . . . 0.0 112.347 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.517 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 41.1 mt -40.14 143.34 0.29 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 46.8 p -126.71 153.35 45.57 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.104 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 485' ' ' GLU . 4.3 pt-20 -40.26 -30.78 0.11 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.874 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.451 ' N ' ' HG3' ' A' ' 484' ' ' GLU . 11.5 tp10 -80.31 -73.64 0.35 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.409 ' O ' ' N ' ' A' ' 489' ' ' LEU . 60.2 p -45.0 -48.03 11.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.13 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.67 -42.27 1.19 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.832 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -61.31 -43.78 98.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.874 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.409 ' N ' ' O ' ' A' ' 486' ' ' THR . 23.4 mt -45.03 -64.4 0.72 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.41 HD11 HD21 ' A' ' 482' ' ' LEU . 75.1 mt -39.87 -57.27 1.62 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.951 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -40.38 -43.58 1.8 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.875 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -79.0 -51.92 8.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 10.9 tmm? -53.69 -63.31 1.19 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 21.4 mt -44.3 -46.34 9.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.936 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -66.06 -41.22 91.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.069 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.2 -44.95 72.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.872 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -69.92 -63.59 1.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.846 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -44.01 -55.74 4.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.085 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -53.48 -44.79 69.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.866 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -79.84 46.37 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.118 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . 93.52 151.83 28.52 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.457 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -164.12 109.68 1.03 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 111.086 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 38.8 mp0 -144.45 155.94 43.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.862 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -157.9 163.18 38.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.831 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . 0.415 ' C ' ' HG3' ' A' ' 506' ' ' LYS . 0.6 OUTLIER -173.42 158.75 3.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.892 -179.89 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . 0.415 ' HG3' ' C ' ' A' ' 505' ' ' GLU . 42.1 mtpt -150.63 176.13 11.28 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.9 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -163.48 144.37 9.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 91.4 t -125.53 103.47 11.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.107 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.9 mp0 -52.36 175.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.895 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -66.06 166.17 12.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 1.8 pp -146.47 129.43 16.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.903 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 51.32 36.55 16.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.94 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . 0.473 ' HG2' ' N ' ' A' ' 514' ' ' SER . 48.0 tttm -38.14 154.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.879 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.473 ' N ' ' HG2' ' A' ' 513' ' ' LYS . 3.9 t -46.45 166.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.864 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 171.98 74.21 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.522 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 -174.95 0.99 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.681 2.254 . . . . 0.0 112.391 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 94.8 p -163.68 169.26 18.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.825 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 56.1 m -144.45 178.04 8.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.881 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 CA-C-O 119.107 -0.829 . . . . 0.0 112.529 -179.966 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.496 -0.241 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 43.1 t -139.42 109.45 6.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.907 0.384 . . . . 0.0 110.876 -179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 36.8 p -38.25 113.2 0.27 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.886 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' A' ' 426' ' ' SER . . . 158.32 66.94 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.53 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.4 ' C ' ' O ' ' A' ' 425' ' ' GLY . 41.8 m -37.67 133.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.932 0.396 . . . . 0.0 110.848 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 38.7 m -102.33 115.08 29.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.854 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 142.79 51.25 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.533 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -120.51 124.48 45.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.857 0.36 . . . . 0.0 110.873 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 22.0 mt -135.05 155.0 79.43 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.592 0.71 . . . . 0.0 110.894 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.83 89.98 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.671 2.247 . . . . 0.0 112.359 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 48.0 mttt -139.65 179.82 6.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -131.08 96.53 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.872 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -75.02 54.19 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . 0.423 ' OE2' ' N ' ' A' ' 436' ' ' LEU . 0.8 OUTLIER -131.08 138.68 49.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 -179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.53 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 40.2 tp -57.91 114.42 2.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.907 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.8 t -47.72 138.42 8.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.92 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 2.4 mppt? -77.02 -3.38 38.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.89 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -110.18 -51.06 2.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.845 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -43.15 -35.75 1.47 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.904 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.8 mt -39.89 -37.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.123 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 16.5 p -99.35 -36.01 9.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.162 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 119.59 -9.08 11.77 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.485 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -97.19 88.88 4.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.875 0.369 . . . . 0.0 110.888 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 51.2 t -128.28 99.38 5.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.854 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -38.63 -61.97 0.65 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.108 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.448 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 61.9 mtt180 -77.31 105.18 8.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.883 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.58 -76.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.098 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 449' ' ' GLU . 32.2 tt0 -82.92 7.02 16.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -107.56 -12.03 15.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 18.4 t -68.63 111.32 7.84 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.587 0.708 . . . . 0.0 110.871 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.8 4.47 2.19 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.672 2.248 . . . . 0.0 112.326 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -99.6 176.46 5.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.927 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 15.1 mmm -88.65 140.95 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.891 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 13.8 m170 -122.14 -74.63 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.878 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.505 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.39 -67.97 1.51 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.455 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.505 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.4 m-20 -29.94 -49.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.884 0.373 . . . . 0.0 110.906 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.53 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 19.4 t80 -41.57 128.2 2.36 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.645 0.736 . . . . 0.0 110.884 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 150.01 67.59 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.67 2.247 . . . . 0.0 112.358 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 52.8 t -72.23 142.29 48.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.901 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -76.83 -66.47 0.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.911 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 464' ' ' HIS . 33.0 mt -45.81 -57.76 4.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -42.48 -23.03 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.933 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.566 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 29.1 m-70 -99.02 -50.17 4.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.869 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.491 ' C ' ' O ' ' A' ' 464' ' ' HIS . 72.0 p -30.51 -47.84 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.118 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.9 p -127.23 -31.91 2.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.163 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.68 -34.05 2.46 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -110.46 145.33 37.84 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 0.0 110.902 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.0 t -106.36 118.64 37.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.84 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 7.9 tp -50.26 -37.84 14.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.172 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -49.92 -50.45 46.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 106.4 -152.86 17.03 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.496 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 11.7 p30 -80.07 12.91 2.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.827 0.346 . . . . 0.0 110.845 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -123.95 34.35 5.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.913 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 45.6 t -79.56 139.58 37.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.863 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.41 ' SD ' ' O ' ' A' ' 476' ' ' MET . 4.4 ppp? -81.1 22.46 0.64 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.401 ' CE2' ' SD ' ' A' ' 476' ' ' MET . 16.0 m-85 -130.9 161.49 31.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.863 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 1.9 m -80.1 127.11 31.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.852 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 20.9 m170 -99.68 26.65 6.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.832 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . 0.41 ' HB2' ' HD2' ' A' ' 481' ' ' PRO . 3.1 p30 -69.68 154.86 94.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.597 0.713 . . . . 0.0 110.886 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 480' ' ' ASP . 53.5 Cg_endo -69.76 120.55 7.32 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.714 2.276 . . . . 0.0 112.372 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.566 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 54.4 mt -39.79 132.06 1.76 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.423 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 69.4 p -109.45 172.24 6.97 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.113 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -49.7 -35.68 22.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.873 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.424 ' O ' ' C ' ' A' ' 486' ' ' THR . 9.4 tp10 -78.54 -75.33 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.909 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.424 ' C ' ' O ' ' A' ' 485' ' ' GLU . 49.6 p -36.37 -52.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.134 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.6 OUTLIER -39.99 -47.12 2.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.871 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.09 -44.35 95.95 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 486' ' ' THR . 78.1 mt -48.85 -65.68 0.53 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 45.2 mt -40.08 -55.27 2.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.926 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -42.81 -41.67 3.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.869 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 492' ' ' LYS . 7.2 tmtm? -76.9 -53.26 8.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.925 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.1 tmm? -50.87 -58.96 4.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.847 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 64.5 mt -56.65 -55.5 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.87 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -48.51 -60.18 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.07 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -41.4 -42.52 2.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.873 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -74.56 -67.39 0.63 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -38.22 -44.05 0.83 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.11 179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' A' ' 500' ' ' ALA . 20.4 tt0 -68.2 -55.33 12.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.894 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 499' ' ' GLU . . . -37.92 -59.1 0.87 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.056 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -164.86 130.58 2.2 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.468 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -91.04 154.74 19.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.762 0.315 . . . . 0.0 111.066 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . 0.465 ' HG2' ' N ' ' A' ' 504' ' ' ASP . 17.2 tt0 -164.5 151.47 11.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . 0.465 ' N ' ' HG2' ' A' ' 503' ' ' GLU . 6.6 m-20 61.47 45.23 8.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -103.39 40.33 1.43 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.872 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 29.3 mtmt -157.18 141.03 16.06 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.857 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 507' ' ' GLU . 0.6 OUTLIER -85.05 125.11 32.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 87.5 t -74.24 81.66 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.154 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -96.23 95.19 7.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.883 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -56.26 150.22 14.87 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 24.1 mt -52.95 -173.18 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.71 49.15 0.39 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.916 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.5 125.81 1.39 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.905 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 4.2 m -162.12 163.77 28.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.84 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -160.61 136.9 4.71 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.495 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.81 -174.86 1.0 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.649 2.233 . . . . 0.0 112.35 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.3 t -124.66 146.66 48.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.817 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 3.6 t -114.79 163.97 14.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.905 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.28 0 CA-C-O 119.151 -0.805 . . . . 0.0 112.434 -179.996 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 11.6 t -161.51 130.82 4.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 0.0 110.836 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 90.4 p -153.15 137.34 16.49 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.892 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 133.96 77.22 0.1 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.476 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 14.5 t -145.36 108.34 4.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.858 0.361 . . . . 0.0 110.852 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 58.6 p -80.5 75.16 7.36 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.793 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -91.67 36.56 3.61 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.526 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -161.05 146.17 14.07 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.87 0.367 . . . . 0.0 110.851 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 40.7 mt -119.76 157.43 52.32 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.591 0.71 . . . . 0.0 110.901 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 2.41 3.58 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.656 2.237 . . . . 0.0 112.354 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 9.7 mmtp -106.48 114.0 27.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.849 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD2' ' CZ ' ' A' ' 453' ' ' TYR . 63.1 mttt -86.52 111.89 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -79.05 48.31 0.84 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.862 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 15.0 tm-20 -121.64 152.39 39.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.911 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.567 ' HB2' ' CE2' ' A' ' 458' ' ' PHE . 40.5 tp -67.52 124.0 22.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.935 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 17.1 t -57.26 127.6 32.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.04 -3.38 16.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -107.62 -44.06 4.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.824 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.45 ' CD2' ' CG ' ' A' ' 455' ' ' HIS . 30.4 t80 -51.65 -38.57 55.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.902 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.7 mt -39.58 -35.38 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.119 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 67.0 p -99.97 -31.27 11.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.133 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 112.89 -4.22 25.79 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.479 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . 0.451 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 9.2 t80 -100.33 85.91 3.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.897 0.379 . . . . 0.0 110.875 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 48.6 t -121.27 102.54 8.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.867 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.14 -69.66 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.408 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.8 mtt85 -76.9 104.65 7.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.909 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.94 -74.55 0.32 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.061 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 19.3 pt-20 -81.93 21.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.944 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -128.82 -4.28 5.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.919 -179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 32.8 t -70.66 111.74 10.68 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.632 0.729 . . . . 0.0 110.906 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 2.39 3.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.694 2.262 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD2' ' A' ' 433' ' ' LYS . 44.4 m-85 -100.99 177.14 5.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 -179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 37.8 mmm -90.97 142.54 27.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.873 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.45 ' CG ' ' CD2' ' A' ' 440' ' ' TYR . 18.5 m170 -120.36 -75.77 0.59 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.474 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.46 -64.84 1.79 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.457 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.474 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.3 m-20 -32.29 -47.79 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.567 ' CE2' ' HB2' ' A' ' 436' ' ' LEU . 21.6 t80 -46.16 122.59 6.43 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.628 0.727 . . . . 0.0 110.864 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 143.86 51.8 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.649 2.232 . . . . 0.0 112.325 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 8.6 t -65.7 135.56 55.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 465' ' ' THR . 6.5 ttpt -73.44 -64.96 0.88 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' A' ' 464' ' ' HIS . 44.3 mt -44.44 -58.31 3.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.848 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.401 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 28.0 t80 -39.11 -25.92 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.891 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' A' ' 462' ' ' LEU . 64.3 m-70 -100.67 -55.33 2.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.822 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 461' ' ' LYS . 30.2 p -32.98 -39.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 81.2 p -128.58 -38.29 1.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.143 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.401 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 138.27 -38.26 1.71 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.523 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -111.01 155.42 22.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.911 0.386 . . . . 0.0 110.856 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 23.9 t -106.52 136.09 46.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.404 HG22 HD13 ' A' ' 462' ' ' LEU . 6.1 tp -76.07 -25.97 17.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.13 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -56.33 -39.38 72.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.852 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 109.75 -161.11 13.12 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.516 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.8 -13.75 59.19 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.832 0.349 . . . . 0.0 110.935 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -99.98 29.62 4.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.864 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.3 t -71.96 131.37 42.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.491 ' C ' ' SD ' ' A' ' 476' ' ' MET . 0.0 OUTLIER -81.25 34.04 0.36 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.894 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.449 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 10.7 m-85 -132.92 155.12 49.65 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.922 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 3.7 m -80.18 127.91 32.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -99.76 15.67 26.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.31 156.23 61.92 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.597 0.713 . . . . 0.0 110.864 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 119.71 6.61 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.615 2.21 . . . . 0.0 112.35 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.525 HD11 ' CD1' ' A' ' 490' ' ' LEU . 29.0 mt -39.87 147.12 0.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.921 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 82.1 p -126.27 157.86 37.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.095 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -41.91 -33.04 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.855 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -80.96 -76.4 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.9 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.448 ' O ' ' N ' ' A' ' 489' ' ' LEU . 59.6 p -44.92 -48.99 11.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.165 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 2.0 tpp85 -38.86 -45.16 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.868 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 55.6 tt0 -56.22 -41.31 75.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.448 ' N ' ' O ' ' A' ' 486' ' ' THR . 51.9 mt -45.88 -62.56 1.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.917 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.525 ' CD1' HD11 ' A' ' 482' ' ' LEU . 81.8 mt -41.74 -56.55 2.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.958 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -42.72 -41.99 3.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 tttt -80.2 -60.01 2.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.89 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . 0.511 ' CE ' HD12 ' A' ' 494' ' ' LEU . 13.4 tmm? -41.6 -57.4 2.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.895 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . 0.511 HD12 ' CE ' ' A' ' 493' ' ' MET . 10.4 mp -56.14 -49.27 74.41 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.933 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -43.41 -53.24 5.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.083 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -55.61 -40.77 72.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.881 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 500' ' ' ALA . 22.6 t0 -67.72 -59.29 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.853 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -53.51 -45.97 69.91 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.103 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -83.99 19.12 1.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.858 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.429 ' CB ' ' O ' ' A' ' 497' ' ' ASP . . . -68.34 91.77 0.4 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.081 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . 0.45 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . -71.28 70.41 0.83 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.483 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . 0.45 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . 33.67 42.34 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.759 0.314 . . . . 0.0 111.04 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 34.5 mp0 -45.83 152.34 0.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.891 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -98.69 121.9 41.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.862 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -142.44 129.97 21.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.92 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 16.5 mtmm -163.11 154.26 17.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -120.77 179.55 4.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.922 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.1 p -105.39 129.43 58.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -90.46 171.42 9.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.884 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 69.9 mt-10 -110.35 134.79 51.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.877 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 5.3 mp -84.93 44.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.911 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' A' ' 513' ' ' LYS . 17.5 tttm 40.23 40.58 0.83 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.914 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . 0.411 ' C ' ' O ' ' A' ' 512' ' ' LYS . 9.4 tmtt? -36.97 122.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.916 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 75.8 m -136.68 155.07 50.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.866 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -152.09 90.96 0.13 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.522 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 179.31 3.79 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.715 2.277 . . . . 0.0 112.325 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 15.4 m -145.94 155.91 43.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.885 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 38.5 m -145.21 167.3 23.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.135 -0.814 . . . . 0.0 112.495 -179.976 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.498 -0.241 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 70.9 m 63.5 42.15 6.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 92.0 p -79.92 148.92 31.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -98.57 -151.51 27.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.506 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 99.7 p -159.9 172.1 18.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.865 0.364 . . . . 0.0 110.885 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 55.3 p -101.34 153.16 19.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.836 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . 0.514 ' O ' HD12 ' A' ' 430' ' ' LEU . . . -115.29 44.9 1.39 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.462 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.07 130.52 47.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.909 0.385 . . . . 0.0 110.832 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 428' ' ' GLY . 7.2 mp -97.56 157.85 34.06 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.62 0.724 . . . . 0.0 110.907 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 3.06 3.02 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.657 2.238 . . . . 0.0 112.287 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -87.26 139.36 30.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.924 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.524 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 18.5 mttp -113.93 149.88 34.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.907 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -118.88 44.77 2.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -120.16 154.48 34.72 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.897 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 35.6 tp -70.86 129.02 37.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.924 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 7.4 t -66.0 131.63 46.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.919 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.42 2.53 9.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.933 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -114.95 -47.46 2.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.862 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . . . . . . . . . 31.6 t80 -48.17 -35.2 11.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.898 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 73.9 mt -41.12 -33.85 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.168 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 66.6 p -99.74 -33.33 10.63 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.09 -9.08 13.95 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.491 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.15 98.57 9.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.895 0.378 . . . . 0.0 110.834 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 49.6 t -134.5 111.56 10.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -40.04 -62.08 0.78 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.089 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.421 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 45.6 mtt180 -85.28 111.07 19.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -81.93 -79.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.086 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -82.06 0.99 37.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.93 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -102.17 -5.07 24.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 9.7 t -70.38 111.92 11.07 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.59 0.71 . . . . 0.0 110.873 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 2.78 3.22 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.659 2.239 . . . . 0.0 112.349 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.524 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -100.29 -176.17 3.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.93 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 21.2 mmm -97.36 138.75 34.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.5 m170 -119.82 -75.39 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.867 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.43 -62.26 2.09 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.486 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.455 ' C ' ' O ' ' A' ' 456' ' ' GLY . 68.9 m-20 -34.18 -50.92 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.864 0.364 . . . . 0.0 110.875 -179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -40.84 127.96 1.94 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.679 0.752 . . . . 0.0 110.886 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 140.42 42.69 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.681 2.254 . . . . 0.0 112.354 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . . . . . . . . . 13.7 t -59.13 144.28 46.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.902 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 465' ' ' THR . 56.1 tttp -77.97 -68.84 0.59 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.86 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.579 HD13 HG22 ' A' ' 470' ' ' ILE . 29.8 mt -45.15 -58.09 3.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.448 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 54.9 t80 -40.25 -24.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.897 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.55 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.5 m-70 -100.17 -52.42 3.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.433 ' C ' ' O ' ' A' ' 464' ' ' HIS . 61.6 p -33.44 -41.0 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.149 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 38.1 p -128.37 -29.22 2.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.13 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.448 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 128.75 -38.74 1.99 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.439 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -109.83 149.08 30.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.851 0.358 . . . . 0.0 110.885 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 14.1 t -102.22 131.43 48.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.898 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.579 HG22 HD13 ' A' ' 462' ' ' LEU . 8.5 tp -77.73 -21.94 13.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.143 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -50.63 -48.25 58.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.872 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 132.14 -168.97 22.33 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.508 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.94 -33.81 72.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 0.0 110.842 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -102.02 64.06 0.93 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.0 t -73.58 153.35 40.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.895 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.535 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 4.9 ppp? -75.61 -20.03 58.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.9 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.535 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 18.0 m-85 -104.26 161.17 14.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.867 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 68.5 m -79.97 151.27 30.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.889 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 48.6 m170 -115.04 30.2 7.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.91 157.86 85.38 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.586 0.708 . . . . 0.0 110.906 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 131.27 20.8 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.713 2.275 . . . . 0.0 112.306 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.55 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 38.6 mt -56.15 149.38 16.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.889 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.4 ' O ' ' N ' ' A' ' 485' ' ' GLU . 66.4 p -136.35 154.97 50.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.132 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.79 -29.7 0.07 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.891 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 483' ' ' THR . 8.4 mt-10 -78.94 -74.9 0.26 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.913 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 26.3 p -48.6 -50.64 31.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.108 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -40.39 -48.53 2.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.852 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -52.52 -40.77 62.81 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.894 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . . . . . . . . . 77.2 mt -53.26 -61.25 2.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.872 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 94.9 mt -41.87 -56.65 2.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.906 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 85.4 m-20 -41.95 -40.61 2.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.871 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.09 -57.18 3.75 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.894 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.7 tmm? -48.96 -60.56 2.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.899 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 96.6 mt -40.97 -44.95 2.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.906 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -63.69 -40.19 96.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.099 179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -50.96 -41.68 59.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.849 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -85.99 -55.45 3.94 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.884 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -43.01 -55.91 3.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.087 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -48.57 -52.07 24.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.861 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -58.06 -60.5 3.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.08 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . 117.79 76.79 0.57 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.504 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . -35.36 102.12 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.748 0.309 . . . . 0.0 111.11 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 -69.87 99.42 1.39 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.876 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -87.75 97.41 10.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -109.29 161.36 15.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.863 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 2.7 ttmp? -140.54 125.01 17.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.872 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -82.25 149.47 27.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.443 HG13 ' O ' ' A' ' 508' ' ' VAL . 8.8 p -112.86 124.15 69.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.138 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -112.29 143.35 43.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -51.87 159.36 0.85 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.859 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.441 ' HG ' ' N ' ' A' ' 512' ' ' LYS . 2.0 pt? -134.77 -35.8 0.86 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.441 ' N ' ' HG ' ' A' ' 511' ' ' LEU . 7.8 ttpt -101.19 41.22 1.21 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.906 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -81.1 95.43 6.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 5.3 t -127.91 165.38 20.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.84 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.19 14.67 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.482 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 -175.58 1.2 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.682 2.255 . . . . 0.0 112.317 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 46.1 m -145.69 154.04 41.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.841 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 19.6 m -158.24 153.77 26.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.855 -179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 CA-C-O 119.102 -0.832 . . . . 0.0 112.516 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 64.4 m -109.08 110.6 21.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.833 0.349 . . . . 0.0 110.862 -179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 88.7 p -110.01 165.52 11.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.843 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 124.77 107.1 1.68 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.464 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 2.3 m -136.13 110.92 8.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.895 0.379 . . . . 0.0 110.838 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 90.4 p -99.53 109.54 22.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.856 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -148.25 96.36 0.17 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.43 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -79.38 166.3 22.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.92 0.39 . . . . 0.0 110.873 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 4.9 mp -128.42 159.51 67.2 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.601 0.715 . . . . 0.0 110.926 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 3.24 2.9 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.693 2.262 . . . . 0.0 112.339 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 17.7 mmtp -93.46 144.34 25.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.498 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 11.3 mttp -105.24 148.75 26.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.583 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.7 mpt_? -121.59 42.98 2.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.867 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -116.58 151.4 36.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.894 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 37.3 tp -58.73 125.99 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.874 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 14.7 t -65.06 146.25 55.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.868 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -79.91 -10.64 59.8 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.88 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -104.1 -46.14 4.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.879 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' A' ' 455' ' ' HIS . 21.9 t80 -47.43 -36.33 9.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.889 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 66.1 mt -42.95 -37.68 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.114 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 70.8 p -101.6 -36.69 8.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.138 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.46 -4.76 17.48 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.51 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . 0.522 ' CG ' ' O ' ' A' ' 444' ' ' PHE . 10.6 t80 -99.63 71.33 1.71 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 110.853 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.77 105.31 15.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.88 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.91 -61.27 0.88 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.104 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . . . . . . . . . 86.7 mtt180 -83.44 109.48 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.871 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.74 -78.58 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.125 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -81.34 -1.21 44.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.872 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -99.4 0.07 41.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 452' ' ' PRO . 10.3 t -80.08 111.11 19.31 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.627 0.727 . . . . 0.0 110.885 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.7 Cg_endo -69.8 3.83 2.56 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.7 2.267 . . . . 0.0 112.336 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.498 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 56.0 m-85 -99.87 179.99 4.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.918 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 23.0 mmm -95.16 140.54 29.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.823 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.408 ' HB3' ' CZ ' ' A' ' 440' ' ' TYR . 18.8 m170 -119.19 -76.11 0.58 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.451 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.37 -65.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.464 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.451 ' C ' ' O ' ' A' ' 456' ' ' GLY . 29.0 m-20 -33.93 -43.69 0.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.862 0.363 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 18.6 t80 -43.19 128.48 3.46 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.598 0.713 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 149.25 66.7 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.645 2.23 . . . . 0.0 112.399 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.467 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 9.2 t -74.28 150.3 40.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.89 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.42 ' O ' HG23 ' A' ' 465' ' ' THR . 16.3 ttmt -80.75 -69.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.502 ' O ' ' N ' ' A' ' 464' ' ' HIS . 30.1 mt -43.77 -60.3 1.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.895 179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . 0.412 ' O ' ' CA ' ' A' ' 467' ' ' GLY . 86.3 t80 -39.29 -25.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.558 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 13.6 m-70 -99.48 -51.67 3.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.818 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.447 ' C ' ' O ' ' A' ' 464' ' ' HIS . 54.2 p -33.78 -38.81 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.126 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.0 p -131.29 -36.71 1.28 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.156 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . 0.412 ' CA ' ' O ' ' A' ' 463' ' ' TYR . . . 140.3 -39.07 1.52 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.483 179.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . 0.438 ' CG ' ' N ' ' A' ' 469' ' ' CYS . 21.2 t-20 -107.79 168.18 9.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.889 0.376 . . . . 0.0 110.884 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . 0.438 ' N ' ' CG ' ' A' ' 468' ' ' ASN . 17.7 t -120.9 150.3 41.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.927 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 9.3 tp -76.02 -36.49 31.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.112 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -52.6 -61.79 2.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.852 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 138.61 -156.64 24.26 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.525 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -66.99 -39.63 87.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.755 0.312 . . . . 0.0 110.851 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -99.67 63.71 1.25 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.89 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 52.6 t -79.06 144.47 34.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.89 -179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.558 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 3.9 ppp? -55.71 -24.2 33.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.875 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.558 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 33.5 m-85 -104.28 160.14 15.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.884 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 4.4 m -80.04 145.87 32.26 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.898 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -111.55 22.58 14.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.891 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . 0.407 ' HB3' ' HD2' ' A' ' 481' ' ' PRO . 71.1 m-20 -58.41 156.35 22.81 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.627 0.727 . . . . 0.0 110.83 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . 0.407 ' HD2' ' HB3' ' A' ' 480' ' ' ASP . 54.4 Cg_endo -69.74 112.1 2.99 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 122.716 2.278 . . . . 0.0 112.358 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.558 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 18.2 mt -39.72 129.37 2.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.93 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 487' ' ' ARG . 7.2 p -102.63 -179.94 4.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.11 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . 0.431 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 0.2 OUTLIER -70.41 -30.83 67.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.879 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.431 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 12.7 pt-20 -79.0 -42.33 26.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.917 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.489 ' O ' ' N ' ' A' ' 489' ' ' LEU . 66.9 p -68.57 -50.85 48.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.132 -179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 483' ' ' THR . 0.0 OUTLIER -39.38 -31.37 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.886 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -70.12 -41.38 74.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.899 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.583 HD22 ' O ' ' A' ' 434' ' ' ARG . 49.9 mt -53.56 -66.06 0.46 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.928 -179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 91.8 mt -39.93 -56.77 1.74 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.907 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -39.69 -41.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.901 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 496' ' ' ASP . 1.7 tppp? -80.09 -42.76 22.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 13.2 tmm? -59.6 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 58.7 mt -49.1 -56.47 9.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.27 71.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.095 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . 0.4 ' CG ' ' O ' ' A' ' 492' ' ' LYS . 64.1 m-20 -43.68 -48.92 7.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.401 ' O ' ' C ' ' A' ' 498' ' ' ALA . 6.0 t70 -78.71 -61.93 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.865 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.401 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -36.3 -50.48 0.75 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.055 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -46.04 -57.74 4.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.895 -179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -49.46 -54.71 16.25 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.113 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.17 -122.6 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.491 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -168.1 130.33 1.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.77 0.319 . . . . 0.0 111.128 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 -120.44 105.75 11.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -98.31 174.43 6.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.891 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -132.98 176.39 8.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.888 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 25.4 ttpt -158.1 133.64 8.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.908 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -146.77 109.43 4.59 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.84 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -75.79 92.24 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.168 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -53.48 149.9 7.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.833 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -75.81 174.2 10.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.696 ' H ' HD23 ' A' ' 511' ' ' LEU . 1.8 pt? -116.75 42.08 2.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 511' ' ' LEU . 50.2 mttt 35.22 42.07 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.915 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . 0.432 ' C ' ' O ' ' A' ' 512' ' ' LYS . 7.5 ttpt -35.53 140.34 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.935 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 70.0 m -146.18 170.64 16.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -141.29 130.33 4.4 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.488 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 -48.51 0.71 Allowed 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.702 2.268 . . . . 0.0 112.322 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 1.2 t 55.65 41.29 30.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.849 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 1.3 t -92.7 169.28 10.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.843 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 CA-C-O 119.147 -0.807 . . . . 0.0 112.464 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.455 -0.258 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 27.5 m -127.09 109.89 12.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.914 0.388 . . . . 0.0 110.854 -179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 1.9 t -42.26 153.79 0.06 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.846 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 120.41 121.6 2.89 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 1.1 t 56.97 41.06 28.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.908 0.385 . . . . 0.0 110.872 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 38.8 m -90.29 174.63 7.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.837 -179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . 156.34 164.59 13.55 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.503 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -119.59 177.43 4.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.847 0.356 . . . . 0.0 110.898 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . . . . . . . . . 73.9 mt -138.14 144.36 43.09 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.595 0.712 . . . . 0.0 110.917 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -168.23 0.26 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.714 2.276 . . . . 0.0 112.331 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 16.1 mmtm 52.85 25.24 3.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.93 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.447 ' N ' ' O ' ' A' ' 452' ' ' PRO . 56.2 mttt -38.37 132.54 1.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.91 179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.668 ' O ' HD22 ' A' ' 489' ' ' LEU . 2.8 tpp85 -89.15 63.75 6.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -139.17 144.08 38.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.854 -179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 458' ' ' PHE . 35.6 tp -61.95 132.5 53.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.923 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . 0.446 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 7.0 t -67.06 137.79 56.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.897 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -77.48 -7.28 55.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.91 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -109.54 -44.12 3.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.46 ' HB2' ' CD2' ' A' ' 455' ' ' HIS . 39.2 t80 -48.13 -34.66 10.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.905 -179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 63.5 mt -43.48 -32.9 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.129 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.2 p -99.51 -33.8 10.51 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.139 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.01 -10.58 13.58 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.501 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -100.43 98.99 9.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 110.865 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 37.6 t -136.42 109.47 7.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.51 -59.31 1.12 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.157 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 7.8 mtm105 -80.49 107.16 13.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.898 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.18 -77.61 0.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.108 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -82.43 -10.41 59.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.898 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -99.45 15.61 25.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.891 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 35.8 t -80.42 111.72 25.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.711 . . . . 0.0 110.923 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 433' ' ' LYS . 54.1 Cg_endo -69.75 3.21 2.9 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.64 2.227 . . . . 0.0 112.368 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -105.35 -175.11 2.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.894 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 40.3 mmm -100.74 136.52 40.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.899 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.46 ' CD2' ' HB2' ' A' ' 440' ' ' TYR . 24.8 m170 -118.13 -75.24 0.58 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.847 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.46 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -79.74 -65.3 1.78 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.516 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.46 ' C ' ' O ' ' A' ' 456' ' ' GLY . 8.3 m-20 -33.44 -47.26 0.21 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.826 0.346 . . . . 0.0 110.847 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 436' ' ' LEU . 17.2 t80 -43.46 130.3 3.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.64 0.734 . . . . 0.0 110.845 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 146.25 59.34 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.685 2.257 . . . . 0.0 112.345 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.533 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 45.4 t -70.19 146.14 50.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.885 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -79.64 -64.96 1.07 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 464' ' ' HIS . 35.2 mt -45.41 -59.77 2.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.958 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -40.91 -22.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' A' ' 460' ' ' CYS . 28.5 m-70 -100.19 -54.96 2.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.904 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.47 ' C ' ' O ' ' A' ' 464' ' ' HIS . 71.8 p -31.17 -41.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.136 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.408 ' N ' ' O ' ' A' ' 464' ' ' HIS . 77.8 p -128.75 -36.78 1.8 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.114 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 137.9 -38.07 1.75 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.476 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -106.72 174.32 5.94 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.866 0.365 . . . . 0.0 110.852 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 7.8 t -133.17 128.7 36.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 6.4 tp -72.11 -26.63 25.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.134 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 34.1 m-20 -49.59 -43.52 46.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.876 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.15 -169.59 23.59 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.505 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -77.6 -29.48 51.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.773 0.321 . . . . 0.0 110.877 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 23.1 m-20 -100.67 44.33 1.02 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 47.7 t -51.17 144.27 9.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.914 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.513 ' SD ' ' CG ' ' A' ' 477' ' ' PHE . 5.1 ppp? -65.42 -17.35 64.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.879 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.513 ' CG ' ' SD ' ' A' ' 476' ' ' MET . 17.8 m-85 -102.81 159.44 15.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 29.1 m -80.13 132.41 35.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.881 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 22.9 m170 -100.8 23.5 10.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.865 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -63.77 159.51 52.94 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.612 0.72 . . . . 0.0 110.859 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 110.79 2.65 Favored 'Trans proline' 0 C--O 1.233 0.231 0 C-N-CA 122.671 2.247 . . . . 0.0 112.332 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.48 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 24.9 mt -40.16 131.5 2.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.914 179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . 0.564 ' OG1' HG23 ' A' ' 486' ' ' THR . 24.8 p -99.59 169.63 9.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.14 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -56.2 -30.98 63.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.874 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -81.41 -55.47 4.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.875 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.575 ' HA ' HD12 ' A' ' 489' ' ' LEU . 47.6 p -55.32 -37.95 68.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.119 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 487' ' ' ARG . 0.0 OUTLIER -52.3 -41.84 63.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.873 -179.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -65.28 -33.39 75.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.874 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.668 HD22 ' O ' ' A' ' 434' ' ' ARG . 62.9 mt -59.39 -65.06 0.73 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 493' ' ' MET . 40.6 mt -40.13 -61.57 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.932 179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -39.95 -41.91 1.27 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.836 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -79.94 -31.02 40.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.879 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . 0.467 ' N ' ' O ' ' A' ' 490' ' ' LEU . 14.0 tmm? -63.32 -59.4 4.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.877 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.4 mp -43.23 -46.69 6.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.886 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -68.8 -53.32 22.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.136 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . 0.401 ' HA ' ' CG ' ' A' ' 499' ' ' GLU . 0.8 OUTLIER -49.43 -38.35 29.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.884 179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -64.51 -55.57 19.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.903 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . 0.475 ' O ' ' N ' ' A' ' 500' ' ' ALA . . . -66.57 -64.3 0.89 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.117 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . 0.568 ' OE2' ' HB2' ' A' ' 500' ' ' ALA . 1.6 pp20? -35.97 -31.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.917 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.568 ' HB2' ' OE2' ' A' ' 499' ' ' GLU . . . -85.3 47.56 1.44 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.124 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . 0.44 ' C ' ' O ' ' A' ' 500' ' ' ALA . . . 34.41 89.58 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.504 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -51.0 114.3 1.14 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.82 0.343 . . . . 0.0 111.111 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.4 172.0 7.76 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.826 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -122.94 167.02 14.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.863 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -143.21 163.4 33.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.879 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 21.9 mtmm -147.64 168.12 22.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.861 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -162.11 149.77 14.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 86.6 t -129.84 125.06 60.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.115 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -83.26 167.58 17.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.896 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' A' ' 512' ' ' LYS . 0.2 OUTLIER -100.76 157.05 16.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.927 -179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.817 HD12 ' O ' ' A' ' 511' ' ' LEU . 3.6 pp -103.2 50.3 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.916 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.426 ' H ' ' CD ' ' A' ' 510' ' ' GLU . 41.9 tttm 40.2 46.58 1.93 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -44.85 116.94 1.18 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.909 179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 13.7 t -174.95 148.97 1.08 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.863 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -119.1 113.98 2.68 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.474 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 171.0 15.25 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.722 2.281 . . . . 0.0 112.333 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 4.6 m -156.64 176.54 12.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.898 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . 0.437 ' O ' ' C ' ' A' ' 519' ' ' GLY . 17.6 m 61.4 42.45 11.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.892 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . 0.437 ' C ' ' O ' ' A' ' 518' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.341 0 CA-C-O 119.097 -0.835 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . . . . . . . . . 23.1 t -62.89 155.28 27.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 110.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 90.6 p -95.35 147.34 23.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.879 -179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . -91.56 147.64 18.9 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.507 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 6.2 t -114.69 114.86 26.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.852 0.358 . . . . 0.0 110.868 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 1.7 m -136.55 121.77 19.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.873 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -115.44 177.24 17.1 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.421 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' A' ' 430' ' ' LEU . 61.3 mm-40 -113.34 153.1 29.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 110.9 -179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' A' ' 429' ' ' GLU . 53.6 mt -35.33 153.37 0.06 OUTLIER Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.629 0.728 . . . . 0.0 110.904 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.73 75.74 1.18 Allowed 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.721 2.281 . . . . 0.0 112.36 179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 42.0 mmtt -152.63 -179.14 7.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -135.8 101.57 4.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.943 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . 0.476 ' HB2' ' CD2' ' A' ' 489' ' ' LEU . 0.0 OUTLIER -83.08 35.12 0.47 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.848 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -115.37 154.59 28.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.884 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . 0.502 HD13 ' CD2' ' A' ' 458' ' ' PHE . 52.4 tp -65.04 117.78 8.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.921 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . 0.468 ' HB3' ' CB ' ' A' ' 440' ' ' TYR . 11.1 t -50.66 116.99 2.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.86 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -60.23 -11.51 6.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.892 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 56.9 m-85 -100.54 -48.68 4.45 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.49 ' CG ' ' CD2' ' A' ' 455' ' ' HIS . 42.3 t80 -47.09 -36.55 8.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . . . . . . . . . 64.6 mt -40.05 -35.31 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.157 179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 20.2 p -100.4 -33.45 10.36 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 117.56 -8.68 15.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.508 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -100.01 94.1 6.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.944 0.402 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 4.5 t -132.68 106.91 8.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.867 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.21 -67.05 0.24 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 25.0 mtm-85 -67.07 101.62 0.9 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.853 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.51 -75.11 0.32 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.072 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -81.34 -6.62 59.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -112.6 23.54 13.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.89 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 53.0 t -73.95 114.77 35.93 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.609 0.719 . . . . 0.0 110.925 179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 -5.92 17.36 Favored 'Trans proline' 0 C--N 1.341 0.139 0 C-N-CA 122.68 2.254 . . . . 0.0 112.358 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -106.59 -173.54 2.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.872 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 20.1 mmm -99.63 148.55 24.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.916 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . 0.49 ' CD2' ' CG ' ' A' ' 440' ' ' TYR . 23.9 m170 -126.3 -76.68 0.58 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.837 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.45 ' O ' ' N ' ' A' ' 458' ' ' PHE . . . -80.91 -65.28 1.72 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.475 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.447 ' C ' ' O ' ' A' ' 456' ' ' GLY . 1.2 m-20 -33.98 -35.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.859 0.361 . . . . 0.0 110.864 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . 0.502 ' CD2' HD13 ' A' ' 436' ' ' LEU . 16.3 t80 -56.79 124.9 66.57 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.665 0.745 . . . . 0.0 110.836 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 135.08 29.66 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.707 2.271 . . . . 0.0 112.365 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.401 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 7.4 t -57.68 147.74 26.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.837 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -80.27 -68.16 0.7 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.902 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 464' ' ' HIS . 25.6 mt -45.52 -58.19 3.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.929 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -41.22 -23.87 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.943 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.557 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 23.4 m-70 -99.91 -51.41 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.821 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.45 ' C ' ' O ' ' A' ' 464' ' ' HIS . 80.8 p -33.11 -48.14 0.21 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.132 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 50.5 p -123.36 -32.32 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.167 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 133.22 -38.57 1.84 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.479 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -105.58 156.96 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.889 0.376 . . . . 0.0 110.873 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . . . . . . . . . 11.4 t -117.3 130.82 56.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.872 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . . . . . . . . . 5.8 tp -57.21 -29.3 31.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.143 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -56.75 -63.53 1.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 136.23 -148.26 19.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.501 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -76.31 -38.44 56.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.803 0.335 . . . . 0.0 110.827 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 28.6 p-10 -100.4 63.17 1.1 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 51.9 t -78.86 147.61 33.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.872 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.565 ' SD ' ' CD2' ' A' ' 477' ' ' PHE . 4.4 ppp? -59.43 -23.59 62.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.565 ' CD2' ' SD ' ' A' ' 476' ' ' MET . 25.0 m-85 -103.53 161.29 14.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.894 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 59.2 m -80.24 141.07 35.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.833 -179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 47.3 m170 -108.89 29.34 7.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.34 152.86 93.78 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.642 0.734 . . . . 0.0 110.869 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.81 116.37 4.53 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.683 2.255 . . . . 0.0 112.33 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.557 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 40.2 mt -40.06 147.54 0.09 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 38.2 p -129.74 155.46 45.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.11 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 485' ' ' GLU . 3.5 pm0 -39.38 -31.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.866 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . 0.401 ' N ' ' HG2' ' A' ' 484' ' ' GLU . 6.0 tm-20 -80.36 -73.99 0.33 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.866 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.689 ' HA ' HD12 ' A' ' 489' ' ' LEU . 15.7 p -47.61 -49.61 26.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.151 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.7 -43.5 1.39 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.872 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -59.71 -41.82 91.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.903 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 486' ' ' THR . 31.5 mt -51.08 -64.79 0.7 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.876 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . 0.515 ' CD1' HD21 ' A' ' 482' ' ' LEU . 44.6 mt -40.62 -59.45 1.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -39.08 -37.31 0.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -38.91 30.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.925 179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . 0.437 ' N ' ' O ' ' A' ' 490' ' ' LEU . 12.1 tmm? -62.8 -58.75 6.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.825 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -46.99 -54.69 9.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.92 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -61.67 -40.68 95.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.115 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -59.59 -62.28 1.99 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.841 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -59.1 -60.22 4.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.856 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -39.61 -53.44 2.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.071 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.39 -60.99 2.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.907 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -78.58 89.28 4.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -102.23 -178.35 27.56 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.506 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . . . . . . . . . . . -65.58 167.58 8.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 71.36 42.26 0.7 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.934 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -134.97 156.13 49.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.857 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -125.67 149.75 48.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.869 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -125.13 121.45 34.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.891 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -164.93 105.39 0.8 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.86 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.55 HG13 ' O ' ' A' ' 508' ' ' VAL . 10.3 p -104.77 114.35 44.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.106 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 80.5 mt-10 -65.53 132.93 50.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.903 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -91.46 36.37 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.884 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.522 ' O ' ' C ' ' A' ' 512' ' ' LYS . 13.3 mt 43.54 51.76 6.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.925 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . 0.522 ' C ' ' O ' ' A' ' 511' ' ' LEU . 0.0 OUTLIER 28.15 43.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.887 179.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 511' ' ' LEU . 4.7 tppp? -37.39 123.61 0.96 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 5.2 t -169.64 165.38 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.851 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . 167.26 95.7 0.1 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.494 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 168.61 21.06 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.664 2.243 . . . . 0.0 112.367 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 54.1 p -162.34 143.57 10.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.89 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 4.5 t -167.58 164.61 14.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.873 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 CA-C-O 119.178 -0.79 . . . . 0.0 112.488 -179.998 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 422' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.462 -0.255 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' SER . . . . . 0.42 ' O ' ' C ' ' A' ' 424' ' ' SER . 23.0 t -170.96 140.12 1.52 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.876 0.37 . . . . 0.0 110.842 -179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 423' ' ' SER . 23.3 t -36.91 151.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.853 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' GLY . . . . . . . . . . . . . . . 75.19 -142.16 28.98 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.514 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 81.2 p -130.72 159.57 36.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.867 0.365 . . . . 0.0 110.826 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 61.0 p -54.35 173.33 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' GLY . . . . . . . . . . . . . . . -117.54 170.68 13.62 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.444 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -88.56 104.03 16.45 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.881 0.372 . . . . 0.0 110.903 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' LEU . . . . . 0.41 HD12 ' H ' ' A' ' 430' ' ' LEU . 0.3 OUTLIER -103.5 164.66 14.98 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.603 0.716 . . . . 0.0 110.89 -179.953 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . 0.407 ' HD2' ' HB2' ' A' ' 430' ' ' LEU . 53.4 Cg_endo -69.77 79.79 0.92 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.665 2.244 . . . . 0.0 112.323 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 35.3 mmtt -154.16 152.03 29.92 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' LYS . . . . . 0.457 ' HD3' ' CZ ' ' A' ' 453' ' ' TYR . 17.0 mttm -122.34 135.56 54.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.885 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' ARG . . . . . . . . . . . . . 38.5 mmm-85 -109.17 39.49 2.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.865 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -112.25 151.09 30.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.895 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' LEU . . . . . . . . . . . . . 14.8 tp -63.77 124.12 20.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.926 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' CYS . . . . . . . . . . . . . 37.8 t -67.75 139.47 56.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.903 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.455 ' HA ' HD12 ' A' ' 441' ' ' ILE . 2.7 mtmp? -79.57 4.75 14.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.873 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' PHE . . . . . . . . . . . . . 25.9 m-85 -109.12 -53.61 2.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.878 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' TYR . . . . . 0.463 ' CE2' ' CE ' ' A' ' 476' ' ' MET . 22.1 t80 -46.89 -39.99 13.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.918 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' ILE . . . . . 0.455 HD12 ' HA ' ' A' ' 438' ' ' LYS . 53.4 mt -40.54 -37.98 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.097 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' THR . . . . . . . . . . . . . 26.7 p -101.7 -35.94 8.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.156 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' GLY . . . . . . . . . . . . . . . 118.02 -9.96 13.78 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.478 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -99.06 87.62 3.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.892 0.377 . . . . 0.0 110.886 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' CYS . . . . . . . . . . . . . 42.4 t -125.01 103.6 8.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.842 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -39.71 -59.08 1.21 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.174 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' ARG . . . . . 0.418 ' O ' ' HB2' ' A' ' 451' ' ' CYS . 82.7 mtt180 -81.98 107.52 14.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.871 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.12 -79.44 0.18 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.136 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -82.6 8.5 11.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.87 -179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -108.34 -12.67 15.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.882 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 447' ' ' ARG . 14.6 t -65.77 111.26 5.92 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.615 0.722 . . . . 0.0 110.893 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 451' ' ' CYS . 53.6 Cg_endo -69.79 2.99 3.05 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.64 2.227 . . . . 0.0 112.342 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' TYR . . . . . 0.457 ' CZ ' ' HD3' ' A' ' 433' ' ' LYS . 80.3 m-85 -100.1 176.1 5.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' MET . . . . . . . . . . . . . 32.1 mmm -91.86 140.66 29.46 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.866 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' HIS . . . . . . . . . . . . . 18.2 m170 -117.81 -77.25 0.57 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.816 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.464 ' O ' ' C ' ' A' ' 457' ' ' ASP . . . -80.84 -66.98 1.58 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.447 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' A' ' 456' ' ' GLY . 25.2 m-20 -32.58 -43.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 110.814 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.52 130.31 6.33 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.626 0.727 . . . . 0.0 110.85 -179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 144.3 53.79 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.714 2.276 . . . . 0.0 112.322 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' CYS . . . . . 0.492 ' O ' ' CD2' ' A' ' 464' ' ' HIS . 20.1 t -65.71 141.95 58.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.845 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' LYS . . . . . 0.439 ' O ' HG23 ' A' ' 465' ' ' THR . 72.3 tttt -75.91 -66.74 0.75 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.879 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 464' ' ' HIS . 28.0 mt -44.67 -58.64 2.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.909 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -39.37 -25.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.948 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' HIS . . . . . 0.54 ' CE1' ' HG ' ' A' ' 482' ' ' LEU . 48.2 m-70 -100.58 -53.14 3.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.856 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' THR . . . . . 0.474 ' C ' ' O ' ' A' ' 464' ' ' HIS . 56.0 p -31.38 -42.28 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.149 -179.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 46.5 p -129.49 -32.92 1.92 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.149 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' GLY . . . . . . . . . . . . . . . 132.95 -41.35 1.5 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.49 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -103.72 150.47 24.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.922 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' CYS . . . . . 0.428 ' SG ' ' ND2' ' A' ' 471' ' ' ASN . 53.3 t -110.69 99.9 8.76 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.87 -179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' ILE . . . . . 0.66 HG23 ' O ' ' A' ' 470' ' ' ILE . 8.1 tp -80.51 38.08 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.137 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' ASN . . . . . 0.428 ' ND2' ' SG ' ' A' ' 469' ' ' CYS . 30.2 m-20 -95.76 -54.73 3.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.892 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' GLY . . . . . . . . . . . . . . . 170.11 154.32 9.3 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.453 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -47.42 -47.54 26.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.819 0.342 . . . . 0.0 110.883 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' ASP . . . . . . . . . . . . . 15.7 p30 -100.92 55.53 0.85 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.866 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 15.6 t -42.06 152.51 0.08 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.885 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' MET . . . . . 0.473 ' SD ' ' CD1' ' A' ' 477' ' ' PHE . 4.2 ppp? -77.31 -18.39 57.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.855 179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.473 ' CD1' ' SD ' ' A' ' 476' ' ' MET . 28.7 m-85 -105.72 158.93 16.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.862 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 67.5 m -80.1 144.81 32.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.852 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -108.12 31.87 5.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -66.75 158.07 81.23 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.602 0.715 . . . . 0.0 110.857 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 134.49 28.12 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.688 2.259 . . . . 0.0 112.377 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.54 ' HG ' ' CE1' ' A' ' 464' ' ' HIS . 44.7 mt -62.13 137.03 58.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' THR . . . . . . . . . . . . . 69.1 p -119.9 152.55 37.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.125 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -40.03 -29.23 0.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -80.71 -75.91 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.838 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.45 ' O ' ' N ' ' A' ' 489' ' ' LEU . 48.6 p -46.9 -47.96 21.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.116 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' ARG . . . . . 0.412 ' HD3' HD13 ' A' ' 482' ' ' LEU . 4.4 tpt180 -40.34 -41.09 1.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 -64.18 -39.27 93.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.946 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' A' ' 486' ' ' THR . 79.1 mt -48.08 -67.49 0.27 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.87 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' LEU . . . . . . . . . . . . . 60.7 mt -41.26 -57.18 2.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -39.96 -42.44 1.36 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.88 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -79.79 -44.61 20.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.882 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' MET . . . . . . . . . . . . . 11.4 tmm? -54.89 -59.29 4.94 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.869 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' LEU . . . . . . . . . . . . . 9.9 mp -50.64 -60.83 2.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.88 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -43.88 -42.51 5.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.073 179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -69.22 -59.61 2.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.404 ' O ' ' C ' ' A' ' 500' ' ' ALA . 9.6 m-20 -57.99 -64.46 0.9 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' ALA . . . . . . . . . . . . . . . -38.14 -64.05 0.44 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.103 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -56.83 -42.91 80.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.886 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.404 ' C ' ' O ' ' A' ' 497' ' ' ASP . . . -114.03 99.27 7.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.056 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . 0.43 ' O ' ' C ' ' A' ' 502' ' ' ALA . . . 141.72 -74.99 0.34 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.463 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 501' ' ' GLY . . . -35.7 115.84 0.34 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.756 0.313 . . . . 0.0 111.083 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 13.4 mp0 -81.49 44.98 0.83 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.879 -179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 40.78 40.46 0.97 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.909 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -74.2 134.38 42.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.876 -179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.2 148.94 29.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.89 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -39.86 138.39 0.79 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.85 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 508' ' ' VAL . 8.1 p -122.83 34.55 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.132 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -172.82 173.65 3.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -81.81 112.64 19.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.895 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 511' ' ' LEU . 4.1 pp -81.2 41.52 0.61 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.951 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' LYS . . . . . . . . . . . . . 29.5 mtmt 61.13 42.52 12.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.868 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.06 -32.39 34.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.882 179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . . . . . . . . . 4.5 t -100.89 102.12 13.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.846 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' GLY . . . . . . . . . . . . . . . -170.23 -100.82 0.14 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.474 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 151.95 69.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.721 2.281 . . . . 0.0 112.34 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 24.9 p -59.6 126.76 28.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.876 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' SER . . . . . . . . . . . . . 3.5 m -57.03 117.09 3.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.856 -179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 CA-C-O 119.181 -0.788 . . . . 0.0 112.484 -179.971 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 622' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 822' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_